N-[2-(2-methylpropanoylamino)ethyl]-1-(2-nitrophenyl)piperidine-4-carboxamide

Systemtic Name: N-[2-(2-methylpropanoylamino)ethyl]-1-(2-nitrophenyl)piperidine-4-carboxamide Openeye Name: N-[2-(2-methylpropanoylamino)ethyl]-1-(2-nitrophenyl)piperidine-4-carboxamide CAS Name: N-[2-[(2-methyl-1-oxopropyl)amino]ethyl]-1-(2-nitrophenyl)-4-piperidinecarboxamide IUPAC Name: N-[2-(2-methylpropanoylamino)ethyl]-1-(2-nitrophenyl)piperidine-4-carboxamide Traditional Name: N-[2-(isobutyrylamino)ethyl]-1-(2-nitrophenyl)isonipecotamide Formula: C18H26N4O4 MolecularWeight: 362.42344

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26N4O4/c1-13(2)17(23)19-9-10-20-18(24)14-7-11-21(12-8-14)15-5-3-4-6-16(15)22(25)26/h3-6,13-14H,7-12H2,1-2H3,(H,19,23)(H,20,24)