4-[2-[(5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl)amino]ethyl]benzenesulfonamide

Systemtic Name: 4-[2-[(5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl)amino]ethyl]benzenesulfonamide Openeye Name: 4-[2-[(5,5-dimethyl-3-oxo-cyclohexen-1-yl)amino]ethyl]benzenesulfonamide CAS Name: 4-[2-[(5,5-dimethyl-3-oxo-1-cyclohexenyl)amino]ethyl]benzenesulfonamide IUPAC Name: 4-[2-[(5,5-dimethyl-3-oxocyclohexen-1-yl)amino]ethyl]benzenesulfonamide Traditional Name: 4-[2-[(3-keto-5,5-dimethyl-cyclohexen-1-yl)amino]ethyl]benzenesulfonamide Formula: C16H22N2O3S MolecularWeight: 322.42248

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=CC(=O)C1)NCCC2=CC=C(C=C2)S(=O)(=O)N)C

Isomeric SMILES

CC1(CC(=CC(=O)C1)NCCC2=CC=C(C=C2)S(=O)(=O)N)C

InChI

InChI=1S/C16H22N2O3S/c1-16(2)10-13(9-14(19)11-16)18-8-7-12-3-5-15(6-4-12)22(17,20)21/h3-6,9,18H,7-8,10-11H2,1-2H3,(H2,17,20,21)