N-[2-(cyclohexen-1-yl)ethyl]-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: N-[2-(cyclohexen-1-yl)ethyl]-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: N-[2-(cyclohexen-1-yl)ethyl]-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]acetamide CAS Name: N-[2-(1-cyclohexenyl)ethyl]-2-[4-(4-methoxyphenyl)sulfonyl-1-piperazinyl]acetamide IUPAC Name: N-[2-(cyclohexen-1-yl)ethyl]-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]acetamide Traditional Name: N-[2-(cyclohexen-1-yl)ethyl]-2-[4-(4-methoxyphenyl)sulfonylpiperazino]acetamide Formula: C21H31N3O4S MolecularWeight: 421.55354

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NCCC3=CCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NCCC3=CCCCC3

InChI

InChI=1S/C21H31N3O4S/c1-28-19-7-9-20(10-8-19)29(26,27)24-15-13-23(14-16-24)17-21(25)22-12-11-18-5-3-2-4-6-18/h5,7-10H,2-4,6,11-17H2,1H3,(H,22,25)