(3S)-3-[(phenylmethyl)sulfonylamino]-3-(4-propoxyphenyl)propanoic acid

Systemtic Name: (3S)-3-[(phenylmethyl)sulfonylamino]-3-(4-propoxyphenyl)propanoic acid Openeye Name: (3S)-3-(benzylsulfonylamino)-3-(4-propoxyphenyl)propanoic acid CAS Name: (3S)-3-[(phenylmethyl)sulfonylamino]-3-(4-propoxyphenyl)propanoic acid IUPAC Name: (3S)-3-(benzylsulfonylamino)-3-(4-propoxyphenyl)propanoic acid Traditional Name: (3S)-3-(benzylsulfonylamino)-3-(4-propoxyphenyl)propionic acid Formula: C19H23NO5S MolecularWeight: 377.45462

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(CC(=O)O)NS(=O)(=O)CC2=CC=CC=C2

Isomeric SMILES

CCCOC1=CC=C(C=C1)[C@H](CC(=O)O)NS(=O)(=O)CC2=CC=CC=C2

InChI

InChI=1S/C19H23NO5S/c1-2-12-25-17-10-8-16(9-11-17)18(13-19(21)22)20-26(23,24)14-15-6-4-3-5-7-15/h3-11,18,20H,2,12-14H2,1H3,(H,21,22)/t18-/m0/s1