2-[2-[3-(4-chlorophenyl)-5-methyl-7-oxidanylidene-furo[3,2-g]chromen-6-yl]ethanoylamino]-3-methylsulfanyl-propanoic acid

Systemtic Name: 2-[2-[3-(4-chlorophenyl)-5-methyl-7-oxidanylidene-furo[3,2-g]chromen-6-yl]ethanoylamino]-3-methylsulfanyl-propanoic acid Openeye Name: 2-[[2-[3-(4-chlorophenyl)-5-methyl-7-oxo-furo[3,2-g]chromen-6-yl]acetyl]amino]-3-methylsulfanyl-propanoic acid CAS Name: 2-[[2-[3-(4-chlorophenyl)-5-methyl-7-oxo-6-furo[3,2-g][1]benzopyranyl]-1-oxoethyl]amino]-3-(methylthio)propanoic acid IUPAC Name: 2-[[2-[3-(4-chlorophenyl)-5-methyl-7-oxofuro[3,2-g]chromen-6-yl]acetyl]amino]-3-methylsulfanylpropanoic acid Traditional Name: 2-[[2-[3-(4-chlorophenyl)-7-keto-5-methyl-furo[3,2-g]chromen-6-yl]acetyl]amino]-3-(methylthio)propionic acid Formula: C24H20ClNO6S MolecularWeight: 485.9367

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=C3C(=C2)OC=C3C4=CC=C(C=C4)Cl)CC(=O)NC(CSC)C(=O)O

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=C3C(=C2)OC=C3C4=CC=C(C=C4)Cl)CC(=O)NC(CSC)C(=O)O

InChI

InChI=1S/C24H20ClNO6S/c1-12-15-7-17-18(13-3-5-14(25)6-4-13)10-31-20(17)9-21(15)32-24(30)16(12)8-22(27)26-19(11-33-2)23(28)29/h3-7,9-10,19H,8,11H2,1-2H3,(H,26,27)(H,28,29)