4-[[3-methoxycarbonyl-5-methyl-4-(4-propylphenyl)thiophen-2-yl]amino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[[3-methoxycarbonyl-5-methyl-4-(4-propylphenyl)thiophen-2-yl]amino]-4-oxidanylidene-butanoate Openeye Name: 4-[[3-methoxycarbonyl-5-methyl-4-(4-propylphenyl)-2-thienyl]amino]-4-oxo-butanoate CAS Name: 4-[[3-methoxycarbonyl-5-methyl-4-(4-propylphenyl)-2-thiophenyl]amino]-4-oxobutanoate IUPAC Name: 4-[[3-methoxycarbonyl-5-methyl-4-(4-propylphenyl)thiophen-2-yl]amino]-4-oxobutanoate Traditional Name: 4-[[3-carbomethoxy-5-methyl-4-(4-propylphenyl)-2-thienyl]amino]-4-keto-butyrate Formula: C20H22NO5S- MolecularWeight: 388.45738

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C2=C(SC(=C2C(=O)OC)NC(=O)CCC(=O)[O-])C

Isomeric SMILES

CCCC1=CC=C(C=C1)C2=C(SC(=C2C(=O)OC)NC(=O)CCC(=O)[O-])C

InChI

InChI=1S/C20H23NO5S/c1-4-5-13-6-8-14(9-7-13)17-12(2)27-19(18(17)20(25)26-3)21-15(22)10-11-16(23)24/h6-9H,4-5,10-11H2,1-3H3,(H,21,22)(H,23,24)/p-1