N-(4-chloranyl-2-methyl-phenyl)-1-(4-nitrophenyl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(4-chloranyl-2-methyl-phenyl)-1-(4-nitrophenyl)carbonyl-piperidine-4-carboxamide Openeye Name: N-(4-chloro-2-methyl-phenyl)-1-(4-nitrobenzoyl)piperidine-4-carboxamide CAS Name: N-(4-chloro-2-methylphenyl)-1-[(4-nitrophenyl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-(4-chloro-2-methylphenyl)-1-(4-nitrobenzoyl)piperidine-4-carboxamide Traditional Name: N-(4-chloro-2-methyl-phenyl)-1-(4-nitrobenzoyl)isonipecotamide Formula: C20H20ClN3O4 MolecularWeight: 401.8435

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)NC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)NC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H20ClN3O4/c1-13-12-16(21)4-7-18(13)22-19(25)14-8-10-23(11-9-14)20(26)15-2-5-17(6-3-15)24(27)28/h2-7,12,14H,8-11H2,1H3,(H,22,25)