4-(3-methylpiperidin-1-yl)-3-nitro-N-pentan-2-yl-benzamide

Systemtic Name: 4-(3-methylpiperidin-1-yl)-3-nitro-N-pentan-2-yl-benzamide Openeye Name: N-(1-methylbutyl)-4-(3-methyl-1-piperidyl)-3-nitro-benzamide CAS Name: 4-(3-methyl-1-piperidinyl)-3-nitro-N-pentan-2-ylbenzamide IUPAC Name: 4-(3-methylpiperidin-1-yl)-3-nitro-N-pentan-2-ylbenzamide Traditional Name: N-(1-methylbutyl)-4-(3-methylpiperidino)-3-nitro-benzamide Formula: C18H27N3O3 MolecularWeight: 333.42528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)C1=CC(=C(C=C1)N2CCCC(C2)C)[N+](=O)[O-]

Isomeric SMILES

CCCC(C)NC(=O)C1=CC(=C(C=C1)N2CCCC(C2)C)[N+](=O)[O-]

InChI

InChI=1S/C18H27N3O3/c1-4-6-14(3)19-18(22)15-8-9-16(17(11-15)21(23)24)20-10-5-7-13(2)12-20/h8-9,11,13-14H,4-7,10,12H2,1-3H3,(H,19,22)