2-(cyclohexen-1-yl)ethyl-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl]azanium

Systemtic Name: 2-(cyclohexen-1-yl)ethyl-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl]azanium Openeye Name: 2-(cyclohexen-1-yl)ethyl-[2-[4-(2-naphthylsulfonyl)piperazin-1-yl]-2-oxo-ethyl]ammonium CAS Name: 2-(1-cyclohexenyl)ethyl-[2-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]-2-oxoethyl]ammonium IUPAC Name: 2-(cyclohexen-1-yl)ethyl-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-oxoethyl]azanium Traditional Name: 2-(cyclohexen-1-yl)ethyl-[2-keto-2-[4-(2-naphthylsulfonyl)piperazino]ethyl]ammonium Formula: C24H32N3O3S+ MolecularWeight: 442.59418

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)CC[NH2+]CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CCC(=CC1)CC[NH2+]CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C24H31N3O3S/c28-24(19-25-13-12-20-6-2-1-3-7-20)26-14-16-27(17-15-26)31(29,30)23-11-10-21-8-4-5-9-22(21)18-23/h4-6,8-11,18,25H,1-3,7,12-17,19H2/p+1