3-(4-hydroxyphenyl)-1-methyl-7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-one

Systemtic Name: 3-(4-hydroxyphenyl)-1-methyl-7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-one Openeye Name: 3-(4-hydroxyphenyl)-1-methyl-7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-one CAS Name: 3-(4-hydroxyphenyl)-1-methyl-7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-one IUPAC Name: 3-(4-hydroxyphenyl)-1-methyl-7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-one Traditional Name: 3-(4-hydroxyphenyl)-1-methyl-7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-one Formula: C22H17N3O4 MolecularWeight: 387.38808

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=NC(C1=O)C3=CC=C(C=C3)O)C4=CC=CC=C4

Isomeric SMILES

CN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=NC(C1=O)C3=CC=C(C=C3)O)C4=CC=CC=C4

InChI

InChI=1S/C22H17N3O4/c1-24-19-12-9-16(25(28)29)13-18(19)20(14-5-3-2-4-6-14)23-21(22(24)27)15-7-10-17(26)11-8-15/h2-13,21,26H,1H3