(S)-carprofen

Properties Image MNX_ID MNXM31803 reference chebi:59207 formula C15H12ClNO2 global charge 0 mol weight 273.719 InChIKey PUXBGTOOZJQSKH-QMMMGPOBSA-N InChI InChI=1S/C15H12ClNO2/c1-8(15(18)19)9-2-4-11-12-7-10(16)3-5-13(12)17-14(11)6-9/h2-8,17H,1H3,(H,18,19)/t8-/m0/s1 SMILES C[C@H](C(=O)O)C1=CC2=C(C=C1)C1=C(C=CC(Cl)=C1)N2 MNX internals InChI (mnx) InChI=1/C15H12ClNO2/c1-8(15(18)19)9-2-4-11-12-7-10(16)3-5-13(12)17-14(11)6-9/h2-8,17H,1H3,(H,18,19)/t8-/m0/s1 SMILES (mnx) [CH3:1][C@@H:8]([C:9]1=[CH:6][C:14]2=[C:11]([CH:4]=[CH:2]1)[C:12]1=[CH:7][C:10]([Cl:16])=[CH:3][CH:5]=[C:13]1[NH:17]2)[C:15](=[O:18])[OH:19]

Parent-child relations graph

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