2-(3-methyl-6-oxidanylidene-11H-benzo[b][1,4]benzodiazepin-5-yl)ethanoic acid

Systemtic Name: 2-(3-methyl-6-oxidanylidene-11H-benzo[b][1,4]benzodiazepin-5-yl)ethanoic acid Openeye Name: 2-(3-methyl-6-oxo-11H-benzo[b][1,4]benzodiazepin-5-yl)acetic acid CAS Name: 2-(3-methyl-6-oxo-11H-benzo[b][1,4]benzodiazepin-5-yl)acetic acid IUPAC Name: 2-(3-methyl-6-oxo-11H-benzo[b][1,4]benzodiazepin-5-yl)acetic acid Traditional Name: 2-(6-keto-3-methyl-11H-benzo[b][1,4]benzodiazepin-5-yl)acetic acid Formula: C16H14N2O3 MolecularWeight: 282.29396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC3=CC=CC=C3C(=O)N2CC(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)NC3=CC=CC=C3C(=O)N2CC(=O)O

InChI

InChI=1S/C16H14N2O3/c1-10-6-7-13-14(8-10)18(9-15(19)20)16(21)11-4-2-3-5-12(11)17-13/h2-8,17H,9H2,1H3,(H,19,20)