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

Systemtic Name: 2-chloranyl-N-(4-piperazin-4-ium-1-ylphenyl)benzamide Openeye Name: 2-chloro-N-(4-piperazin-4-ium-1-ylphenyl)benzamide CAS Name: 2-chloro-N-[4-(1-piperazin-4-iumyl)phenyl]benzamide IUPAC Name: 2-chloro-N-(4-piperazin-4-ium-1-ylphenyl)benzamide Traditional Name: 2-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=C3Cl

Isomeric SMILES

C1CN(CC[NH2+]1)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3Cl

InChI

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