2-chloranyl-N-[3-[4-[(3-chlorophenyl)methyl]piperazin-4-ium-1-yl]-3-oxidanylidene-propyl]benzamide

Systemtic Name: 2-chloranyl-N-[3-[4-[(3-chlorophenyl)methyl]piperazin-4-ium-1-yl]-3-oxidanylidene-propyl]benzamide Openeye Name: 2-chloro-N-[3-[4-[(3-chlorophenyl)methyl]piperazin-4-ium-1-yl]-3-oxo-propyl]benzamide CAS Name: 2-chloro-N-[3-[4-[(3-chlorophenyl)methyl]-1-piperazin-4-iumyl]-3-oxopropyl]benzamide IUPAC Name: 2-chloro-N-[3-[4-[(3-chlorophenyl)methyl]piperazin-4-ium-1-yl]-3-oxopropyl]benzamide Traditional Name: 2-chloro-N-[3-[4-(3-chlorobenzyl)piperazin-4-ium-1-yl]-3-keto-propyl]benzamide Formula: C21H24Cl2N3O2+ MolecularWeight: 421.34016

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC(=CC=C2)Cl)C(=O)CCNC(=O)C3=CC=CC=C3Cl

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC(=CC=C2)Cl)C(=O)CCNC(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C21H23Cl2N3O2/c22-17-5-3-4-16(14-17)15-25-10-12-26(13-11-25)20(27)8-9-24-21(28)18-6-1-2-7-19(18)23/h1-7,14H,8-13,15H2,(H,24,28)/p+1