4-[[3-methoxycarbonyl-4-[4-(2-methylpropyl)phenyl]thiophen-2-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[3-methoxycarbonyl-4-[4-(2-methylpropyl)phenyl]thiophen-2-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[4-(4-isobutylphenyl)-3-methoxycarbonyl-2-thienyl]amino]-4-oxo-butanoic acid CAS Name: 4-[[3-methoxycarbonyl-4-[4-(2-methylpropyl)phenyl]-2-thiophenyl]amino]-4-oxobutanoic acid IUPAC Name: 4-[[3-methoxycarbonyl-4-[4-(2-methylpropyl)phenyl]thiophen-2-yl]amino]-4-oxobutanoic acid Traditional Name: 4-[[3-carbomethoxy-4-(4-isobutylphenyl)-2-thienyl]amino]-4-keto-butyric acid Formula: C20H23NO5S MolecularWeight: 389.46532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)CCC(=O)O

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)CCC(=O)O

InChI

InChI=1S/C20H23NO5S/c1-12(2)10-13-4-6-14(7-5-13)15-11-27-19(18(15)20(25)26-3)21-16(22)8-9-17(23)24/h4-7,11-12H,8-10H2,1-3H3,(H,21,22)(H,23,24)