N-(cyclohexen-1-yl)-N-cyclopropyl-2-[4-(phenylcarbonyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(cyclohexen-1-yl)-N-cyclopropyl-2-[4-(phenylcarbonyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: 2-(4-benzoylpiperazin-1-ium-1-yl)-N-(cyclohexen-1-yl)-N-cyclopropyl-acetamide CAS Name: 2-(4-benzoyl-1-piperazin-1-iumyl)-N-(1-cyclohexenyl)-N-cyclopropylacetamide IUPAC Name: 2-(4-benzoylpiperazin-1-ium-1-yl)-N-(cyclohexen-1-yl)-N-cyclopropylacetamide Traditional Name: 2-(4-benzoylpiperazin-1-ium-1-yl)-N-(cyclohexen-1-yl)-N-cyclopropyl-acetamide Formula: C22H30N3O2+ MolecularWeight: 368.4925

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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=C4

Isomeric SMILES

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

InChI

InChI=1S/C22H29N3O2/c26-21(25(20-11-12-20)19-9-5-2-6-10-19)17-23-13-15-24(16-14-23)22(27)18-7-3-1-4-8-18/h1,3-4,7-9,20H,2,5-6,10-17H2/p+1