[(1S,2R)-2-[methylsulfonyl-(phenylmethyl)amino]-1-phenyl-propyl] propanoate

Systemtic Name: [(1S,2R)-2-[methylsulfonyl-(phenylmethyl)amino]-1-phenyl-propyl] propanoate Openeye Name: [(1S,2R)-2-[benzyl(methylsulfonyl)amino]-1-phenyl-propyl] propanoate CAS Name: propanoic acid [(1S,2R)-2-[methylsulfonyl-(phenylmethyl)amino]-1-phenylpropyl] ester IUPAC Name: [(1S,2R)-2-[benzyl(methylsulfonyl)amino]-1-phenylpropyl] propanoate Traditional Name: propionic acid [(1S,2R)-2-[benzyl(mesyl)amino]-1-phenyl-propyl] ester Formula: C20H25NO4S MolecularWeight: 375.4818

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC(C1=CC=CC=C1)C(C)N(CC2=CC=CC=C2)S(=O)(=O)C

Isomeric SMILES

CCC(=O)O[C@@H](C1=CC=CC=C1)[C@@H](C)N(CC2=CC=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C20H25NO4S/c1-4-19(22)25-20(18-13-9-6-10-14-18)16(2)21(26(3,23)24)15-17-11-7-5-8-12-17/h5-14,16,20H,4,15H2,1-3H3/t16-,20-/m1/s1