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

Systemtic Name: 2-[2-(1,3-benzodioxol-5-yl)-7-propan-2-yl-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[2-(1,3-benzodioxol-5-yl)-7-isopropyl-1H-indol-3-yl]acetic acid CAS Name: 2-[2-(1,3-benzodioxol-5-yl)-7-propan-2-yl-1H-indol-3-yl]acetic acid IUPAC Name: 2-[2-(1,3-benzodioxol-5-yl)-7-propan-2-yl-1H-indol-3-yl]acetic acid Traditional Name: 2-[2-(1,3-benzodioxol-5-yl)-7-isopropyl-1H-indol-3-yl]acetic acid Formula: C20H19NO4 MolecularWeight: 337.36916

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC2=C1NC(=C2CC(=O)O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(C)C1=CC=CC2=C1NC(=C2CC(=O)O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H19NO4/c1-11(2)13-4-3-5-14-15(9-18(22)23)19(21-20(13)14)12-6-7-16-17(8-12)25-10-24-16/h3-8,11,21H,9-10H2,1-2H3,(H,22,23)