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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CCCCC2C3=C(C=CC=C3OS(=O)(=O)C)C(=O)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2CCCCC2C3=C(C=CC=C3OS(=O)(=O)C)C(=O)N)OC

InChI

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