N-(4-acetamido-3-chloranyl-phenyl)-1-(2-nitrophenyl)piperidine-4-carboxamide

Systemtic Name: N-(4-acetamido-3-chloranyl-phenyl)-1-(2-nitrophenyl)piperidine-4-carboxamide Openeye Name: N-(4-acetamido-3-chloro-phenyl)-1-(2-nitrophenyl)piperidine-4-carboxamide CAS Name: N-(4-acetamido-3-chlorophenyl)-1-(2-nitrophenyl)-4-piperidinecarboxamide IUPAC Name: N-(4-acetamido-3-chlorophenyl)-1-(2-nitrophenyl)piperidine-4-carboxamide Traditional Name: N-(4-acetamido-3-chloro-phenyl)-1-(2-nitrophenyl)isonipecotamide Formula: C20H21ClN4O4 MolecularWeight: 416.85814

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21ClN4O4/c1-13(26)22-17-7-6-15(12-16(17)21)23-20(27)14-8-10-24(11-9-14)18-4-2-3-5-19(18)25(28)29/h2-7,12,14H,8-11H2,1H3,(H,22,26)(H,23,27)