2-[3-(1-benzothiophen-2-ylcarbonyl)-5-(4-methylphenyl)indol-1-yl]ethanoic acid

Systemtic Name: 2-[3-(1-benzothiophen-2-ylcarbonyl)-5-(4-methylphenyl)indol-1-yl]ethanoic acid Openeye Name: 2-[3-(benzothiophene-2-carbonyl)-5-(p-tolyl)indol-1-yl]acetic acid CAS Name: 2-[3-[1-benzothiophen-2-yl(oxo)methyl]-5-(4-methylphenyl)-1-indolyl]acetic acid IUPAC Name: 2-[3-(1-benzothiophene-2-carbonyl)-5-(4-methylphenyl)indol-1-yl]acetic acid Traditional Name: 2-[3-(benzothiophene-2-carbonyl)-5-(p-tolyl)indol-1-yl]acetic acid Formula: C26H19NO3S MolecularWeight: 425.49896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC3=C(C=C2)N(C=C3C(=O)C4=CC5=CC=CC=C5S4)CC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC3=C(C=C2)N(C=C3C(=O)C4=CC5=CC=CC=C5S4)CC(=O)O

InChI

InChI=1S/C26H19NO3S/c1-16-6-8-17(9-7-16)18-10-11-22-20(12-18)21(14-27(22)15-25(28)29)26(30)24-13-19-4-2-3-5-23(19)31-24/h2-14H,15H2,1H3,(H,28,29)