2-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-N-methyl-N-(4-nitrophenyl)ethanamide

Systemtic Name: 2-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-N-methyl-N-(4-nitrophenyl)ethanamide Openeye Name: 2-[4-(azepane-1-carbonyl)-1-piperidyl]-N-methyl-N-(4-nitrophenyl)acetamide CAS Name: 2-[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]-N-methyl-N-(4-nitrophenyl)acetamide IUPAC Name: 2-[4-(azepane-1-carbonyl)piperidin-1-yl]-N-methyl-N-(4-nitrophenyl)acetamide Traditional Name: 2-[4-(azepane-1-carbonyl)piperidino]-N-methyl-N-(4-nitrophenyl)acetamide Formula: C21H30N4O4 MolecularWeight: 402.4873

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)[N+](=O)[O-])C(=O)CN2CCC(CC2)C(=O)N3CCCCCC3

Isomeric SMILES

CN(C1=CC=C(C=C1)[N+](=O)[O-])C(=O)CN2CCC(CC2)C(=O)N3CCCCCC3

InChI

InChI=1S/C21H30N4O4/c1-22(18-6-8-19(9-7-18)25(28)29)20(26)16-23-14-10-17(11-15-23)21(27)24-12-4-2-3-5-13-24/h6-9,17H,2-5,10-16H2,1H3