2-[(7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-yl)amino]ethanoic acid

Systemtic Name: 2-[(7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-yl)amino]ethanoic acid Openeye Name: 2-[(7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-yl)amino]acetic acid CAS Name: 2-[(7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-yl)amino]acetic acid IUPAC Name: 2-[(7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-yl)amino]acetic acid Traditional Name: 2-[(7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-yl)amino]acetic acid Formula: C17H14N4O4 MolecularWeight: 338.31746

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NC2=C(C=C(C=C2)[N+](=O)[O-])C(=N1)C3=CC=CC=C3)NCC(=O)O

Isomeric SMILES

C1C(=NC2=C(C=C(C=C2)[N+](=O)[O-])C(=N1)C3=CC=CC=C3)NCC(=O)O

InChI

InChI=1S/C17H14N4O4/c22-16(23)10-18-15-9-19-17(11-4-2-1-3-5-11)13-8-12(21(24)25)6-7-14(13)20-15/h1-8H,9-10H2,(H,18,20)(H,22,23)