[1-(4-methylidenecyclohexyl)ethylamino] 4-[(3-methoxy-5-methyl-phenyl)methoxy]benzenesulfonate

Systemtic Name: [1-(4-methylidenecyclohexyl)ethylamino] 4-[(3-methoxy-5-methyl-phenyl)methoxy]benzenesulfonate Openeye Name: [1-(4-methylenecyclohexyl)ethylamino] 4-[(3-methoxy-5-methyl-phenyl)methoxy]benzenesulfonate CAS Name: 4-[(3-methoxy-5-methylphenyl)methoxy]benzenesulfonic acid [1-(4-methylenecyclohexyl)ethylamino] ester IUPAC Name: [1-(4-methylidenecyclohexyl)ethylamino] 4-[(3-methoxy-5-methylphenyl)methoxy]benzenesulfonate Traditional Name: 4-(3-methoxy-5-methyl-benzyl)oxybenzenesulfonic acid [1-(4-methylenecyclohexyl)ethylamino] ester Formula: C24H31NO5S MolecularWeight: 445.57164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC)COC2=CC=C(C=C2)S(=O)(=O)ONC(C)C3CCC(=C)CC3

Isomeric SMILES

CC1=CC(=CC(=C1)OC)COC2=CC=C(C=C2)S(=O)(=O)ONC(C)C3CCC(=C)CC3

InChI

InChI=1S/C24H31NO5S/c1-17-5-7-21(8-6-17)19(3)25-30-31(26,27)24-11-9-22(10-12-24)29-16-20-13-18(2)14-23(15-20)28-4/h9-15,19,21,25H,1,5-8,16H2,2-4H3