4-[(3R)-3-methylpiperidin-1-yl]-3-nitro-N-pentan-3-yl-benzamide

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCC(CC)NC(=O)C1=CC(=C(C=C1)N2CCC[C@H](C2)C)[N+](=O)[O-]

InChI

InChI=1S/C18H27N3O3/c1-4-15(5-2)19-18(22)14-8-9-16(17(11-14)21(23)24)20-10-6-7-13(3)12-20/h8-9,11,13,15H,4-7,10,12H2,1-3H3,(H,19,22)/t13-/m1/s1