2-[4-methoxy-3-(2-methoxyphenyl)-2-[(phenylmethyl)carbamoyl]phenyl]ethyl methanesulfonate

Systemtic Name: 2-[4-methoxy-3-(2-methoxyphenyl)-2-[(phenylmethyl)carbamoyl]phenyl]ethyl methanesulfonate Openeye Name: 2-[2-(benzylcarbamoyl)-4-methoxy-3-(2-methoxyphenyl)phenyl]ethyl methanesulfonate CAS Name: methanesulfonic acid 2-[4-methoxy-3-(2-methoxyphenyl)-2-[oxo-[(phenylmethyl)amino]methyl]phenyl]ethyl ester IUPAC Name: 2-[2-(benzylcarbamoyl)-4-methoxy-3-(2-methoxyphenyl)phenyl]ethyl methanesulfonate Traditional Name: methanesulfonic acid 2-[2-(benzylcarbamoyl)-4-methoxy-3-(2-methoxyphenyl)phenyl]ethyl ester Formula: C25H27NO6S MolecularWeight: 469.54998

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CCOS(=O)(=O)C)C(=O)NCC2=CC=CC=C2)C3=CC=CC=C3OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CCOS(=O)(=O)C)C(=O)NCC2=CC=CC=C2)C3=CC=CC=C3OC

InChI

InChI=1S/C25H27NO6S/c1-30-21-12-8-7-11-20(21)24-22(31-2)14-13-19(15-16-32-33(3,28)29)23(24)25(27)26-17-18-9-5-4-6-10-18/h4-14H,15-17H2,1-3H3,(H,26,27)