(3S)-3-(4-propan-2-yloxyphenyl)-3-(2-thiophen-2-ylethanoylamino)propanoate

Systemtic Name: (3S)-3-(4-propan-2-yloxyphenyl)-3-(2-thiophen-2-ylethanoylamino)propanoate Openeye Name: (3S)-3-(4-isopropoxyphenyl)-3-[[2-(2-thienyl)acetyl]amino]propanoate CAS Name: (3S)-3-[(1-oxo-2-thiophen-2-ylethyl)amino]-3-(4-propan-2-yloxyphenyl)propanoate IUPAC Name: (3S)-3-(4-propan-2-yloxyphenyl)-3-[(2-thiophen-2-ylacetyl)amino]propanoate Traditional Name: (3S)-3-(4-isopropoxyphenyl)-3-[[2-(2-thienyl)acetyl]amino]propionate Formula: C18H20NO4S- MolecularWeight: 346.4207

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C(CC(=O)[O-])NC(=O)CC2=CC=CS2

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)[C@H](CC(=O)[O-])NC(=O)CC2=CC=CS2

InChI

InChI=1S/C18H21NO4S/c1-12(2)23-14-7-5-13(6-8-14)16(11-18(21)22)19-17(20)10-15-4-3-9-24-15/h3-9,12,16H,10-11H2,1-2H3,(H,19,20)(H,21,22)/p-1/t16-/m0/s1