(3-chlorophenyl)-(4-prop-2-enylpiperazin-4-ium-1-yl)methanone

Systemtic Name: (3-chlorophenyl)-(4-prop-2-enylpiperazin-4-ium-1-yl)methanone Openeye Name: (4-allylpiperazin-4-ium-1-yl)-(3-chlorophenyl)methanone CAS Name: (3-chlorophenyl)-(4-prop-2-enyl-1-piperazin-4-iumyl)methanone IUPAC Name: (3-chlorophenyl)-(4-prop-2-enylpiperazin-4-ium-1-yl)methanone Traditional Name: (4-allylpiperazin-4-ium-1-yl)-(3-chlorophenyl)methanone Formula: C14H18ClN2O+ MolecularWeight: 265.75852

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Descriptors Computed from Structure

Canonical SMILES:

C=CC[NH+]1CCN(CC1)C(=O)C2=CC(=CC=C2)Cl

Isomeric SMILES

C=CC[NH+]1CCN(CC1)C(=O)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C14H17ClN2O/c1-2-6-16-7-9-17(10-8-16)14(18)12-4-3-5-13(15)11-12/h2-5,11H,1,6-10H2/p+1