(3R,3aS,7R,7aS)-7-methyl-3-(2-naphthalenyl)-2-(phenylmethyl)-3a,6,7,7a-tetrahydro-3H-isoindol-1-one

Properties Image MNX_ID MNXM172039 reference chebi:121879 formula C26H25NO global charge 0 mol weight 367.492 InChIKey RBOGTOKHHDCLPU-DNQHQPOYSA-N InChI InChI=1S/C26H25NO/c1-18-8-7-13-23-24(18)26(28)27(17-19-9-3-2-4-10-19)25(23)22-15-14-20-11-5-6-12-21(20)16-22/h2-7,9-16,18,23-25H,8,17H2,1H3/t18-,23+,24+,25+/m1/s1 SMILES C[C@@H]1CC=C[C@H]2[C@H]1C(=O)N(CC1=CC=CC=C1)[C@H]2C1=CC2=CC=CC=C2C=C1 MNX internals InChI (mnx) InChI=1/C26H25NO/c1-18-8-7-13-23-24(18)26(28)27(17-19-9-3-2-4-10-19)25(23)22-15-14-20-11-5-6-12-21(20)16-22/h2-7,9-16,18,23-25H,8,17H2,1H3/t18-,23+,24+,25+/m1/s1 SMILES (mnx) [CH3:1][C@@H:18]1[CH2:8][CH:7]=[CH:13][C@H:23]2[C@H:24]1[C:26](=[O:28])[N:27]([CH2:17][C:19]1=[CH:9][CH:3]=[CH:2][CH:4]=[CH:10]1)[C@H:25]2[C:22]1=[CH:16][C:21]2=[CH:12][CH:6]=[CH:5][CH:11]=[C:20]2[CH:14]=[CH:15]1

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0