[4-(methylamino)-3-nitro-phenyl]-[2-(3-methylpiperidin-1-yl)carbonylphenyl]methanone

Systemtic Name: [4-(methylamino)-3-nitro-phenyl]-[2-(3-methylpiperidin-1-yl)carbonylphenyl]methanone Openeye Name: [4-(methylamino)-3-nitro-phenyl]-[2-(3-methylpiperidine-1-carbonyl)phenyl]methanone CAS Name: [4-(methylamino)-3-nitrophenyl]-[2-[(3-methyl-1-piperidinyl)-oxomethyl]phenyl]methanone IUPAC Name: [4-(methylamino)-3-nitrophenyl]-[2-(3-methylpiperidine-1-carbonyl)phenyl]methanone Traditional Name: [4-(methylamino)-3-nitro-phenyl]-[2-(3-methylpiperidine-1-carbonyl)phenyl]methanone Formula: C21H23N3O4 MolecularWeight: 381.42502

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)C2=CC=CC=C2C(=O)C3=CC(=C(C=C3)NC)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)C(=O)C2=CC=CC=C2C(=O)C3=CC(=C(C=C3)NC)[N+](=O)[O-]

InChI

InChI=1S/C21H23N3O4/c1-14-6-5-11-23(13-14)21(26)17-8-4-3-7-16(17)20(25)15-9-10-18(22-2)19(12-15)24(27)28/h3-4,7-10,12,14,22H,5-6,11,13H2,1-2H3