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

Systemtic Name: methyl 2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]-4-methylsulfanyl-butanoate Openeye Name: methyl 2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]-4-methylsulfanyl-butanoate CAS Name: 2-[[(E)-3-(4-methoxyphenyl)-1-oxoprop-2-enyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl 2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]-4-methylsulfanylbutanoate Traditional Name: 2-[[(E)-3-(4-methoxyphenyl)acryloyl]amino]-4-(methylthio)butyric acid methyl ester Formula: C16H21NO4S MolecularWeight: 323.40724

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CC(=O)NC(CCSC)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/C(=O)NC(CCSC)C(=O)OC

InChI

InChI=1S/C16H21NO4S/c1-20-13-7-4-12(5-8-13)6-9-15(18)17-14(10-11-22-3)16(19)21-2/h4-9,14H,10-11H2,1-3H3,(H,17,18)/b9-6+