[3-[[2-(3,4-dimethoxyphenyl)cyclohexyl]carbamoyl]phenyl] methanesulfonate

Systemtic Name: [3-[[2-(3,4-dimethoxyphenyl)cyclohexyl]carbamoyl]phenyl] methanesulfonate Openeye Name: [3-[[2-(3,4-dimethoxyphenyl)cyclohexyl]carbamoyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [3-[[[2-(3,4-dimethoxyphenyl)cyclohexyl]amino]-oxomethyl]phenyl] ester IUPAC Name: [3-[[2-(3,4-dimethoxyphenyl)cyclohexyl]carbamoyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [3-[[2-(3,4-dimethoxyphenyl)cyclohexyl]carbamoyl]phenyl] ester Formula: C22H27NO6S MolecularWeight: 433.51788

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CCCCC2NC(=O)C3=CC(=CC=C3)OS(=O)(=O)C)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2CCCCC2NC(=O)C3=CC(=CC=C3)OS(=O)(=O)C)OC

InChI

InChI=1S/C22H27NO6S/c1-27-20-12-11-15(14-21(20)28-2)18-9-4-5-10-19(18)23-22(24)16-7-6-8-17(13-16)29-30(3,25)26/h6-8,11-14,18-19H,4-5,9-10H2,1-3H3,(H,23,24)