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

Systemtic Name: N-butan-2-yl-4-(3-methylpiperidin-1-yl)-3-nitro-benzamide Openeye Name: 4-(3-methyl-1-piperidyl)-3-nitro-N-sec-butyl-benzamide CAS Name: N-butan-2-yl-4-(3-methyl-1-piperidinyl)-3-nitrobenzamide IUPAC Name: N-butan-2-yl-4-(3-methylpiperidin-1-yl)-3-nitrobenzamide Traditional Name: 4-(3-methylpiperidino)-3-nitro-N-sec-butyl-benzamide Formula: C17H25N3O3 MolecularWeight: 319.3987

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25N3O3/c1-4-13(3)18-17(21)14-7-8-15(16(10-14)20(22)23)19-9-5-6-12(2)11-19/h7-8,10,12-13H,4-6,9,11H2,1-3H3,(H,18,21)