2-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-N-(4-methoxy-2-nitro-phenyl)ethanamide

Systemtic Name: 2-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-N-(4-methoxy-2-nitro-phenyl)ethanamide Openeye Name: 2-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-N-(4-methoxy-2-nitro-phenyl)acetamide CAS Name: 2-[4-[(3-chlorophenyl)methyl]-1-piperazinyl]-N-(4-methoxy-2-nitrophenyl)acetamide IUPAC Name: 2-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-N-(4-methoxy-2-nitrophenyl)acetamide Traditional Name: 2-[4-(3-chlorobenzyl)piperazino]-N-(4-methoxy-2-nitro-phenyl)acetamide Formula: C20H23ClN4O4 MolecularWeight: 418.87402

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)CN2CCN(CC2)CC3=CC(=CC=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)CN2CCN(CC2)CC3=CC(=CC=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H23ClN4O4/c1-29-17-5-6-18(19(12-17)25(27)28)22-20(26)14-24-9-7-23(8-10-24)13-15-3-2-4-16(21)11-15/h2-6,11-12H,7-10,13-14H2,1H3,(H,22,26)