N-(3,4-dimethylphenyl)-1-[1-(3-nitrophenyl)carbonylpiperidin-4-yl]piperidine-4-carboxamide

Systemtic Name: N-(3,4-dimethylphenyl)-1-[1-(3-nitrophenyl)carbonylpiperidin-4-yl]piperidine-4-carboxamide Openeye Name: N-(3,4-dimethylphenyl)-1-[1-(3-nitrobenzoyl)-4-piperidyl]piperidine-4-carboxamide CAS Name: N-(3,4-dimethylphenyl)-1-[1-[(3-nitrophenyl)-oxomethyl]-4-piperidinyl]-4-piperidinecarboxamide IUPAC Name: N-(3,4-dimethylphenyl)-1-[1-(3-nitrobenzoyl)piperidin-4-yl]piperidine-4-carboxamide Traditional Name: N-(3,4-dimethylphenyl)-1-[1-(3-nitrobenzoyl)-4-piperidyl]isonipecotamide Formula: C26H32N4O4 MolecularWeight: 464.55668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)C3CCN(CC3)C(=O)C4=CC(=CC=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)C3CCN(CC3)C(=O)C4=CC(=CC=C4)[N+](=O)[O-])C

InChI

InChI=1S/C26H32N4O4/c1-18-6-7-22(16-19(18)2)27-25(31)20-8-12-28(13-9-20)23-10-14-29(15-11-23)26(32)21-4-3-5-24(17-21)30(33)34/h3-7,16-17,20,23H,8-15H2,1-2H3,(H,27,31)