2-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-N-(4-chloranyl-2-nitro-phenyl)ethanamide

Systemtic Name: 2-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-N-(4-chloranyl-2-nitro-phenyl)ethanamide Openeye Name: 2-[4-(azepane-1-carbonyl)-1-piperidyl]-N-(4-chloro-2-nitro-phenyl)acetamide CAS Name: 2-[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]-N-(4-chloro-2-nitrophenyl)acetamide IUPAC Name: 2-[4-(azepane-1-carbonyl)piperidin-1-yl]-N-(4-chloro-2-nitrophenyl)acetamide Traditional Name: 2-[4-(azepane-1-carbonyl)piperidino]-N-(4-chloro-2-nitro-phenyl)acetamide Formula: C20H27ClN4O4 MolecularWeight: 422.90578

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CCN(CC2)CC(=O)NC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CCN(CC2)CC(=O)NC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H27ClN4O4/c21-16-5-6-17(18(13-16)25(28)29)22-19(26)14-23-11-7-15(8-12-23)20(27)24-9-3-1-2-4-10-24/h5-6,13,15H,1-4,7-12,14H2,(H,22,26)