4-[[4-[(4-chlorophenyl)methyl]piperazin-1-yl]methyl]-3-nitro-benzamide

Systemtic Name: 4-[[4-[(4-chlorophenyl)methyl]piperazin-1-yl]methyl]-3-nitro-benzamide Openeye Name: 4-[[4-[(4-chlorophenyl)methyl]piperazin-1-yl]methyl]-3-nitro-benzamide CAS Name: 4-[[4-[(4-chlorophenyl)methyl]-1-piperazinyl]methyl]-3-nitrobenzamide IUPAC Name: 4-[[4-[(4-chlorophenyl)methyl]piperazin-1-yl]methyl]-3-nitrobenzamide Traditional Name: 4-[[4-(4-chlorobenzyl)piperazino]methyl]-3-nitro-benzamide Formula: C19H21ClN4O3 MolecularWeight: 388.84804

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)Cl)CC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)Cl)CC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C19H21ClN4O3/c20-17-5-1-14(2-6-17)12-22-7-9-23(10-8-22)13-16-4-3-15(19(21)25)11-18(16)24(26)27/h1-6,11H,7-10,12-13H2,(H2,21,25)