2-[3-(3,4-dimethylphenyl)-1-(3,4,5-trimethoxyphenyl)carbonyl-pyrrolidin-3-yl]ethyl methanesulfonate

Systemtic Name: 2-[3-(3,4-dimethylphenyl)-1-(3,4,5-trimethoxyphenyl)carbonyl-pyrrolidin-3-yl]ethyl methanesulfonate Openeye Name: 2-[3-(3,4-dimethylphenyl)-1-(3,4,5-trimethoxybenzoyl)pyrrolidin-3-yl]ethyl methanesulfonate CAS Name: methanesulfonic acid 2-[3-(3,4-dimethylphenyl)-1-[oxo-(3,4,5-trimethoxyphenyl)methyl]-3-pyrrolidinyl]ethyl ester IUPAC Name: 2-[3-(3,4-dimethylphenyl)-1-(3,4,5-trimethoxybenzoyl)pyrrolidin-3-yl]ethyl methanesulfonate Traditional Name: methanesulfonic acid 2-[3-(3,4-dimethylphenyl)-1-(3,4,5-trimethoxybenzoyl)pyrrolidin-3-yl]ethyl ester Formula: C25H33NO7S MolecularWeight: 491.59702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2(CCN(C2)C(=O)C3=CC(=C(C(=C3)OC)OC)OC)CCOS(=O)(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2(CCN(C2)C(=O)C3=CC(=C(C(=C3)OC)OC)OC)CCOS(=O)(=O)C)C

InChI

InChI=1S/C25H33NO7S/c1-17-7-8-20(13-18(17)2)25(10-12-33-34(6,28)29)9-11-26(16-25)24(27)19-14-21(30-3)23(32-5)22(15-19)31-4/h7-8,13-15H,9-12,16H2,1-6H3