5-[[4-(3-chlorophenyl)-3-methoxycarbonyl-5-methyl-thiophen-2-yl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[[4-(3-chlorophenyl)-3-methoxycarbonyl-5-methyl-thiophen-2-yl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[[4-(3-chlorophenyl)-3-methoxycarbonyl-5-methyl-2-thienyl]amino]-5-oxo-pentanoic acid CAS Name: 5-[[4-(3-chlorophenyl)-3-methoxycarbonyl-5-methyl-2-thiophenyl]amino]-5-oxopentanoic acid IUPAC Name: 5-[[4-(3-chlorophenyl)-3-methoxycarbonyl-5-methylthiophen-2-yl]amino]-5-oxopentanoic acid Traditional Name: 5-[[3-carbomethoxy-4-(3-chlorophenyl)-5-methyl-2-thienyl]amino]-5-keto-valeric acid Formula: C18H18ClNO5S MolecularWeight: 395.85722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)CCCC(=O)O)C(=O)OC)C2=CC(=CC=C2)Cl

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)CCCC(=O)O)C(=O)OC)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C18H18ClNO5S/c1-10-15(11-5-3-6-12(19)9-11)16(18(24)25-2)17(26-10)20-13(21)7-4-8-14(22)23/h3,5-6,9H,4,7-8H2,1-2H3,(H,20,21)(H,22,23)