2-[3-naphthalen-1-yl-1-[2-(3-propan-2-yloxyphenyl)ethanoyl]pyrrolidin-3-yl]ethyl methanesulfonate

Systemtic Name: 2-[3-naphthalen-1-yl-1-[2-(3-propan-2-yloxyphenyl)ethanoyl]pyrrolidin-3-yl]ethyl methanesulfonate Openeye Name: 2-[1-[2-(3-isopropoxyphenyl)acetyl]-3-(1-naphthyl)pyrrolidin-3-yl]ethyl methanesulfonate CAS Name: methanesulfonic acid 2-[3-(1-naphthalenyl)-1-[1-oxo-2-(3-propan-2-yloxyphenyl)ethyl]-3-pyrrolidinyl]ethyl ester IUPAC Name: 2-[3-naphthalen-1-yl-1-[2-(3-propan-2-yloxyphenyl)acetyl]pyrrolidin-3-yl]ethyl methanesulfonate Traditional Name: methanesulfonic acid 2-[1-[2-(3-isopropoxyphenyl)acetyl]-3-(1-naphthyl)pyrrolidin-3-yl]ethyl ester Formula: C28H33NO5S MolecularWeight: 495.63032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC(=C1)CC(=O)N2CCC(C2)(CCOS(=O)(=O)C)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC(C)OC1=CC=CC(=C1)CC(=O)N2CCC(C2)(CCOS(=O)(=O)C)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C28H33NO5S/c1-21(2)34-24-11-6-8-22(18-24)19-27(30)29-16-14-28(20-29,15-17-33-35(3,31)32)26-13-7-10-23-9-4-5-12-25(23)26/h4-13,18,21H,14-17,19-20H2,1-3H3