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

Systemtic Name: 7-chloranyl-1-(3-methyl-4-nitro-phenyl)carbonyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one Openeye Name: 7-chloro-1-(3-methyl-4-nitro-benzoyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one CAS Name: 7-chloro-1-[(3-methyl-4-nitrophenyl)-oxomethyl]-3,5-dihydro-2H-1,5-benzodiazepin-4-one IUPAC Name: 7-chloro-1-(3-methyl-4-nitrobenzoyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one Traditional Name: 7-chloro-1-(3-methyl-4-nitro-benzoyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one Formula: C17H14ClN3O4 MolecularWeight: 359.76376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)N2CCC(=O)NC3=C2C=CC(=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N2CCC(=O)NC3=C2C=CC(=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H14ClN3O4/c1-10-8-11(2-4-14(10)21(24)25)17(23)20-7-6-16(22)19-13-9-12(18)3-5-15(13)20/h2-5,8-9H,6-7H2,1H3,(H,19,22)