2-methoxy-4-(6-oxidanylidene-5,11-dihydrobenzo[b][1,4]benzodiazepin-9-yl)benzamide

Systemtic Name: 2-methoxy-4-(6-oxidanylidene-5,11-dihydrobenzo[b][1,4]benzodiazepin-9-yl)benzamide Openeye Name: 2-methoxy-4-(6-oxo-5,11-dihydrobenzo[b][1,4]benzodiazepin-9-yl)benzamide CAS Name: 2-methoxy-4-(6-oxo-5,11-dihydrobenzo[b][1,4]benzodiazepin-9-yl)benzamide IUPAC Name: 2-methoxy-4-(6-oxo-5,11-dihydrobenzo[b][1,4]benzodiazepin-9-yl)benzamide Traditional Name: 4-(6-keto-5,11-dihydrobenzo[b][1,4]benzodiazepin-9-yl)-2-methoxy-benzamide Formula: C21H17N3O3 MolecularWeight: 359.37798

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2=CC3=C(C=C2)C(=O)NC4=CC=CC=C4N3)C(=O)N

Isomeric SMILES

COC1=C(C=CC(=C1)C2=CC3=C(C=C2)C(=O)NC4=CC=CC=C4N3)C(=O)N

InChI

InChI=1S/C21H17N3O3/c1-27-19-11-13(7-9-15(19)20(22)25)12-6-8-14-18(10-12)23-16-4-2-3-5-17(16)24-21(14)26/h2-11,23H,1H3,(H2,22,25)(H,24,26)