N-(6-methylheptan-2-yl)-1-(2-nitrophenyl)piperidine-4-carboxamide

Systemtic Name: N-(6-methylheptan-2-yl)-1-(2-nitrophenyl)piperidine-4-carboxamide Openeye Name: N-(1,5-dimethylhexyl)-1-(2-nitrophenyl)piperidine-4-carboxamide CAS Name: N-(6-methylheptan-2-yl)-1-(2-nitrophenyl)-4-piperidinecarboxamide IUPAC Name: N-(6-methylheptan-2-yl)-1-(2-nitrophenyl)piperidine-4-carboxamide Traditional Name: N-(1,5-dimethylhexyl)-1-(2-nitrophenyl)isonipecotamide Formula: C20H31N3O3 MolecularWeight: 361.47844

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)NC(=O)C1CCN(CC1)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC(C)CCCC(C)NC(=O)C1CCN(CC1)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C20H31N3O3/c1-15(2)7-6-8-16(3)21-20(24)17-11-13-22(14-12-17)18-9-4-5-10-19(18)23(25)26/h4-5,9-10,15-17H,6-8,11-14H2,1-3H3,(H,21,24)