| Properties | Image |
MNX_ID | MNXM527758 |
 |
reference | chebi:90446 |
formula | C15H17N3O2 |
global charge | 0 |
mol weight | 271.32 |
InChIKey | SCBLXQAXDOWFIH-ZDUSSCGKSA-N |
InChI | InChI=1S/C15H17N3O2/c16-13(7-8-14(17)19)15(20)18-12-6-5-10-3-1-2-4-11(10)9-12/h1-6,9,13H,7-8,16H2,(H2,17,19)(H,18,20)/t13-/m0/s1 |
SMILES | NC(=O)CC[C@H](N)C(=O)NC1=CC=C2C=CC=CC2=C1 |
MNX internals
InChI (mnx) | InChI=1/C15H17N3O2/c16-13(7-8-14(17)19)15(20)18-12-6-5-10-3-1-2-4-11(10)9-12/h1-6,9,13H,7-8,16H2,(H2,17,19)(H,18,20)/t13-/m0/s1 |
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SMILES (mnx) | [CH:1]1=[CH:2][CH:4]=[C:11]2[CH:9]=[C:12]([N:18]=[C:15]([C@H:13]([CH2:7][CH2:8][C:14](=[NH:17])[OH:19])[NH2:16])[OH:20])[CH:6]=[CH:5][C:10]2=[CH:3]1 |
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