[(2R)-1-(naphthalen-2-ylamino)-1-oxidanylidene-propan-2-yl] 3-(methylsulfonylmethyl)benzoate

Systemtic Name: [(2R)-1-(naphthalen-2-ylamino)-1-oxidanylidene-propan-2-yl] 3-(methylsulfonylmethyl)benzoate Openeye Name: [(1R)-1-methyl-2-(2-naphthylamino)-2-oxo-ethyl] 3-(methylsulfonylmethyl)benzoate CAS Name: 3-(methylsulfonylmethyl)benzoic acid [(2R)-1-(2-naphthalenylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(naphthalen-2-ylamino)-1-oxopropan-2-yl] 3-(methylsulfonylmethyl)benzoate Traditional Name: 3-(mesylmethyl)benzoic acid [(1R)-2-keto-1-methyl-2-(2-naphthylamino)ethyl] ester Formula: C22H21NO5S MolecularWeight: 411.47084

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=CC=CC=C2C=C1)OC(=O)C3=CC(=CC=C3)CS(=O)(=O)C

Isomeric SMILES

C[C@H](C(=O)NC1=CC2=CC=CC=C2C=C1)OC(=O)C3=CC(=CC=C3)CS(=O)(=O)C

InChI

InChI=1S/C22H21NO5S/c1-15(21(24)23-20-11-10-17-7-3-4-8-18(17)13-20)28-22(25)19-9-5-6-16(12-19)14-29(2,26)27/h3-13,15H,14H2,1-2H3,(H,23,24)/t15-/m1/s1