2-[2-(1,3-benzodioxol-5-yl)-6,7-dimethyl-1H-indol-3-yl]ethanoic acid

Systemtic Name: 2-[2-(1,3-benzodioxol-5-yl)-6,7-dimethyl-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[2-(1,3-benzodioxol-5-yl)-6,7-dimethyl-1H-indol-3-yl]acetic acid CAS Name: 2-[2-(1,3-benzodioxol-5-yl)-6,7-dimethyl-1H-indol-3-yl]acetic acid IUPAC Name: 2-[2-(1,3-benzodioxol-5-yl)-6,7-dimethyl-1H-indol-3-yl]acetic acid Traditional Name: 2-[2-(1,3-benzodioxol-5-yl)-6,7-dimethyl-1H-indol-3-yl]acetic acid Formula: C19H17NO4 MolecularWeight: 323.34258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=C(N2)C3=CC4=C(C=C3)OCO4)CC(=O)O)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=C(N2)C3=CC4=C(C=C3)OCO4)CC(=O)O)C

InChI

InChI=1S/C19H17NO4/c1-10-3-5-13-14(8-17(21)22)19(20-18(13)11(10)2)12-4-6-15-16(7-12)24-9-23-15/h3-7,20H,8-9H2,1-2H3,(H,21,22)