1-(2-nitrophenyl)-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]piperidine-4-carboxamide

Systemtic Name: 1-(2-nitrophenyl)-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]piperidine-4-carboxamide Openeye Name: N-[[4-(isopropylcarbamoylamino)phenyl]methyl]-1-(2-nitrophenyl)piperidine-4-carboxamide CAS Name: 1-(2-nitrophenyl)-N-[[4-[[oxo-(propan-2-ylamino)methyl]amino]phenyl]methyl]-4-piperidinecarboxamide IUPAC Name: 1-(2-nitrophenyl)-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]piperidine-4-carboxamide Traditional Name: N-[4-(isopropylcarbamoylamino)benzyl]-1-(2-nitrophenyl)isonipecotamide Formula: C23H29N5O4 MolecularWeight: 439.50746

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC1=CC=C(C=C1)CNC(=O)C2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC(C)NC(=O)NC1=CC=C(C=C1)CNC(=O)C2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C23H29N5O4/c1-16(2)25-23(30)26-19-9-7-17(8-10-19)15-24-22(29)18-11-13-27(14-12-18)20-5-3-4-6-21(20)28(31)32/h3-10,16,18H,11-15H2,1-2H3,(H,24,29)(H2,25,26,30)