1-[4-[(4-dimethylaminophenyl)methylamino]-3-nitro-phenyl]ethanone

Systemtic Name: 1-[4-[(4-dimethylaminophenyl)methylamino]-3-nitro-phenyl]ethanone Openeye Name: 1-[4-[(4-dimethylaminophenyl)methylamino]-3-nitro-phenyl]ethanone CAS Name: 1-[4-[(4-dimethylaminophenyl)methylamino]-3-nitrophenyl]ethanone IUPAC Name: 1-[4-[(4-dimethylaminophenyl)methylamino]-3-nitrophenyl]ethanone Traditional Name: 1-[4-[[4-(dimethylamino)benzyl]amino]-3-nitro-phenyl]ethanone Formula: C17H19N3O3 MolecularWeight: 313.35106

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)NCC2=CC=C(C=C2)N(C)C)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)NCC2=CC=C(C=C2)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C17H19N3O3/c1-12(21)14-6-9-16(17(10-14)20(22)23)18-11-13-4-7-15(8-5-13)19(2)3/h4-10,18H,11H2,1-3H3