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

Systemtic Name: N-[[4-(diethylaminomethyl)phenyl]methyl]-1-(2-nitrophenyl)piperidine-4-carboxamide Openeye Name: N-[[4-(diethylaminomethyl)phenyl]methyl]-1-(2-nitrophenyl)piperidine-4-carboxamide CAS Name: N-[[4-(diethylaminomethyl)phenyl]methyl]-1-(2-nitrophenyl)-4-piperidinecarboxamide IUPAC Name: N-[[4-(diethylaminomethyl)phenyl]methyl]-1-(2-nitrophenyl)piperidine-4-carboxamide Traditional Name: N-[4-(diethylaminomethyl)benzyl]-1-(2-nitrophenyl)isonipecotamide Formula: C24H32N4O3 MolecularWeight: 424.53588

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H32N4O3/c1-3-26(4-2)18-20-11-9-19(10-12-20)17-25-24(29)21-13-15-27(16-14-21)22-7-5-6-8-23(22)28(30)31/h5-12,21H,3-4,13-18H2,1-2H3,(H,25,29)