N-(2-chloranyl-4,6-dimethyl-phenyl)-1-(2-nitrophenyl)piperidine-4-carboxamide

Systemtic Name: N-(2-chloranyl-4,6-dimethyl-phenyl)-1-(2-nitrophenyl)piperidine-4-carboxamide Openeye Name: N-(2-chloro-4,6-dimethyl-phenyl)-1-(2-nitrophenyl)piperidine-4-carboxamide CAS Name: N-(2-chloro-4,6-dimethylphenyl)-1-(2-nitrophenyl)-4-piperidinecarboxamide IUPAC Name: N-(2-chloro-4,6-dimethylphenyl)-1-(2-nitrophenyl)piperidine-4-carboxamide Traditional Name: N-(2-chloro-4,6-dimethyl-phenyl)-1-(2-nitrophenyl)isonipecotamide Formula: C20H22ClN3O3 MolecularWeight: 387.85998

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22ClN3O3/c1-13-11-14(2)19(16(21)12-13)22-20(25)15-7-9-23(10-8-15)17-5-3-4-6-18(17)24(26)27/h3-6,11-12,15H,7-10H2,1-2H3,(H,22,25)