2-(6-methyl-5-thiophen-2-ylcarbonyl-[1,3]dioxolo[4,5-f]indol-7-yl)ethanoic acid

Systemtic Name: 2-(6-methyl-5-thiophen-2-ylcarbonyl-[1,3]dioxolo[4,5-f]indol-7-yl)ethanoic acid Openeye Name: 2-[6-methyl-5-(thiophene-2-carbonyl)-[1,3]dioxolo[4,5-f]indol-7-yl]acetic acid CAS Name: 2-[6-methyl-5-[oxo(thiophen-2-yl)methyl]-[1,3]dioxolo[4,5-f]indol-7-yl]acetic acid IUPAC Name: 2-[6-methyl-5-(thiophene-2-carbonyl)-[1,3]dioxolo[4,5-f]indol-7-yl]acetic acid Traditional Name: 2-[6-methyl-5-(2-thenoyl)-[1,3]dioxol[4,5-f]indol-7-yl]acetic acid Formula: C17H13NO5S MolecularWeight: 343.35382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC3=C(C=C2N1C(=O)C4=CC=CS4)OCO3)CC(=O)O

Isomeric SMILES

CC1=C(C2=CC3=C(C=C2N1C(=O)C4=CC=CS4)OCO3)CC(=O)O

InChI

InChI=1S/C17H13NO5S/c1-9-10(6-16(19)20)11-5-13-14(23-8-22-13)7-12(11)18(9)17(21)15-3-2-4-24-15/h2-5,7H,6,8H2,1H3,(H,19,20)