2-[4-(2-chlorophenyl)carbonylpiperazin-1-ium-1-yl]-N-(cyclohexen-1-yl)-N-cyclopropyl-ethanamide

Systemtic Name: 2-[4-(2-chlorophenyl)carbonylpiperazin-1-ium-1-yl]-N-(cyclohexen-1-yl)-N-cyclopropyl-ethanamide Openeye Name: 2-[4-(2-chlorobenzoyl)piperazin-1-ium-1-yl]-N-(cyclohexen-1-yl)-N-cyclopropyl-acetamide CAS Name: 2-[4-[(2-chlorophenyl)-oxomethyl]-1-piperazin-1-iumyl]-N-(1-cyclohexenyl)-N-cyclopropylacetamide IUPAC Name: 2-[4-(2-chlorobenzoyl)piperazin-1-ium-1-yl]-N-(cyclohexen-1-yl)-N-cyclopropylacetamide Traditional Name: 2-[4-(2-chlorobenzoyl)piperazin-1-ium-1-yl]-N-(cyclohexen-1-yl)-N-cyclopropyl-acetamide Formula: C22H29ClN3O2+ MolecularWeight: 402.93756

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)N(C2CC2)C(=O)C[NH+]3CCN(CC3)C(=O)C4=CC=CC=C4Cl

Isomeric SMILES

C1CCC(=CC1)N(C2CC2)C(=O)C[NH+]3CCN(CC3)C(=O)C4=CC=CC=C4Cl

InChI

InChI=1S/C22H28ClN3O2/c23-20-9-5-4-8-19(20)22(28)25-14-12-24(13-15-25)16-21(27)26(18-10-11-18)17-6-2-1-3-7-17/h4-6,8-9,18H,1-3,7,10-16H2/p+1