propan-2-yl 3-(4-methylsulfonyloxyphenyl)-2-[(phenylmethyl)amino]propanoate

Systemtic Name: propan-2-yl 3-(4-methylsulfonyloxyphenyl)-2-[(phenylmethyl)amino]propanoate Openeye Name: isopropyl 2-(benzylamino)-3-(4-methylsulfonyloxyphenyl)propanoate CAS Name: 3-(4-methylsulfonyloxyphenyl)-2-[(phenylmethyl)amino]propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-(benzylamino)-3-(4-methylsulfonyloxyphenyl)propanoate Traditional Name: 2-(benzylamino)-3-(4-methylsulfonyloxyphenyl)propionic acid isopropyl ester Formula: C20H25NO5S MolecularWeight: 391.4812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(CC1=CC=C(C=C1)OS(=O)(=O)C)NCC2=CC=CC=C2

Isomeric SMILES

CC(C)OC(=O)C(CC1=CC=C(C=C1)OS(=O)(=O)C)NCC2=CC=CC=C2

InChI

InChI=1S/C20H25NO5S/c1-15(2)25-20(22)19(21-14-17-7-5-4-6-8-17)13-16-9-11-18(12-10-16)26-27(3,23)24/h4-12,15,19,21H,13-14H2,1-3H3