(3-chlorophenyl)-(4-phenethylpiperazin-4-ium-1-yl)methanone

Systemtic Name: (3-chlorophenyl)-(4-phenethylpiperazin-4-ium-1-yl)methanone Openeye Name: (3-chlorophenyl)-(4-phenethylpiperazin-4-ium-1-yl)methanone CAS Name: (3-chlorophenyl)-(4-phenethyl-1-piperazin-4-iumyl)methanone IUPAC Name: (3-chlorophenyl)-(4-phenethylpiperazin-4-ium-1-yl)methanone Traditional Name: (3-chlorophenyl)-(4-phenethylpiperazin-4-ium-1-yl)methanone Formula: C19H22ClN2O+ MolecularWeight: 329.84378

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCC2=CC=CC=C2)C(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

C1CN(CC[NH+]1CCC2=CC=CC=C2)C(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C19H21ClN2O/c20-18-8-4-7-17(15-18)19(23)22-13-11-21(12-14-22)10-9-16-5-2-1-3-6-16/h1-8,15H,9-14H2/p+1