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

Systemtic Name: (2R)-2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]-4-methylsulfanyl-butanoate Openeye Name: (2R)-2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]-4-methylsulfanyl-butanoate CAS Name: (2R)-2-[[(E)-3-(4-methoxyphenyl)-1-oxoprop-2-enyl]amino]-4-(methylthio)butanoate IUPAC Name: (2R)-2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]-4-methylsulfanylbutanoate Traditional Name: (2R)-2-[[(E)-3-(4-methoxyphenyl)acryloyl]amino]-4-(methylthio)butyrate Formula: C15H18NO4S- MolecularWeight: 308.37272

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CC(=O)NC(CCSC)C(=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/C(=O)N[C@H](CCSC)C(=O)[O-]

InChI

InChI=1S/C15H19NO4S/c1-20-12-6-3-11(4-7-12)5-8-14(17)16-13(15(18)19)9-10-21-2/h3-8,13H,9-10H2,1-2H3,(H,16,17)(H,18,19)/p-1/b8-5+/t13-/m1/s1