N-[(2-chlorophenyl)methyl]-2-[4-(6-nitropyridin-3-yl)piperazin-1-yl]ethanamide

Systemtic Name: N-[(2-chlorophenyl)methyl]-2-[4-(6-nitropyridin-3-yl)piperazin-1-yl]ethanamide Openeye Name: N-[(2-chlorophenyl)methyl]-2-[4-(6-nitro-3-pyridyl)piperazin-1-yl]acetamide CAS Name: N-[(2-chlorophenyl)methyl]-2-[4-(6-nitro-3-pyridinyl)-1-piperazinyl]acetamide IUPAC Name: N-[(2-chlorophenyl)methyl]-2-[4-(6-nitropyridin-3-yl)piperazin-1-yl]acetamide Traditional Name: N-(2-chlorobenzyl)-2-[4-(6-nitro-3-pyridyl)piperazino]acetamide Formula: C18H20ClN5O3 MolecularWeight: 389.8361

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)NCC2=CC=CC=C2Cl)C3=CN=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC(=O)NCC2=CC=CC=C2Cl)C3=CN=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H20ClN5O3/c19-16-4-2-1-3-14(16)11-21-18(25)13-22-7-9-23(10-8-22)15-5-6-17(20-12-15)24(26)27/h1-6,12H,7-11,13H2,(H,21,25)