3-chloranyl-N-(4-piperazin-4-ium-1-ylphenyl)benzamide

Systemtic Name: 3-chloranyl-N-(4-piperazin-4-ium-1-ylphenyl)benzamide Openeye Name: 3-chloro-N-(4-piperazin-4-ium-1-ylphenyl)benzamide CAS Name: 3-chloro-N-[4-(1-piperazin-4-iumyl)phenyl]benzamide IUPAC Name: 3-chloro-N-(4-piperazin-4-ium-1-ylphenyl)benzamide Traditional Name: 3-chloro-N-(4-piperazin-4-ium-1-ylphenyl)benzamide Formula: C17H19ClN3O+ MolecularWeight: 316.80526

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

C1CN(CC[NH2+]1)C2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C17H18ClN3O/c18-14-3-1-2-13(12-14)17(22)20-15-4-6-16(7-5-15)21-10-8-19-9-11-21/h1-7,12,19H,8-11H2,(H,20,22)/p+1