methyl (2R)-2-[[(E)-3-(2-ethoxyphenyl)prop-2-enoyl]amino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl (2R)-2-[[(E)-3-(2-ethoxyphenyl)prop-2-enoyl]amino]-4-methylsulfanyl-butanoate Openeye Name: methyl (2R)-2-[[(E)-3-(2-ethoxyphenyl)prop-2-enoyl]amino]-4-methylsulfanyl-butanoate CAS Name: (2R)-2-[[(E)-3-(2-ethoxyphenyl)-1-oxoprop-2-enyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[(E)-3-(2-ethoxyphenyl)prop-2-enoyl]amino]-4-methylsulfanylbutanoate Traditional Name: (2R)-4-(methylthio)-2-[[(E)-3-o-phenetylacryloyl]amino]butyric acid methyl ester Formula: C17H23NO4S MolecularWeight: 337.43382

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C=CC(=O)NC(CCSC)C(=O)OC

Isomeric SMILES

CCOC1=CC=CC=C1/C=C/C(=O)N[C@H](CCSC)C(=O)OC

InChI

InChI=1S/C17H23NO4S/c1-4-22-15-8-6-5-7-13(15)9-10-16(19)18-14(11-12-23-3)17(20)21-2/h5-10,14H,4,11-12H2,1-3H3,(H,18,19)/b10-9+/t14-/m1/s1