(3S)-3-(2-phenylethanoylamino)-3-(4-propoxyphenyl)propanoate

Systemtic Name: (3S)-3-(2-phenylethanoylamino)-3-(4-propoxyphenyl)propanoate Openeye Name: (3S)-3-[(2-phenylacetyl)amino]-3-(4-propoxyphenyl)propanoate CAS Name: (3S)-3-[(1-oxo-2-phenylethyl)amino]-3-(4-propoxyphenyl)propanoate IUPAC Name: (3S)-3-[(2-phenylacetyl)amino]-3-(4-propoxyphenyl)propanoate Traditional Name: (3S)-3-[(2-phenylacetyl)amino]-3-(4-propoxyphenyl)propionate Formula: C20H22NO4- MolecularWeight: 340.39298

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(CC(=O)[O-])NC(=O)CC2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C20H23NO4/c1-2-12-25-17-10-8-16(9-11-17)18(14-20(23)24)21-19(22)13-15-6-4-3-5-7-15/h3-11,18H,2,12-14H2,1H3,(H,21,22)(H,23,24)/p-1/t18-/m0/s1