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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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