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

Systemtic Name: 2-[2-(1,3-benzodioxol-5-yl)-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[2-(1,3-benzodioxol-5-yl)-1H-indol-3-yl]acetic acid CAS Name: 2-[2-(1,3-benzodioxol-5-yl)-1H-indol-3-yl]acetic acid IUPAC Name: 2-[2-(1,3-benzodioxol-5-yl)-1H-indol-3-yl]acetic acid Traditional Name: 2-[2-(1,3-benzodioxol-5-yl)-1H-indol-3-yl]acetic acid Formula: C17H13NO4 MolecularWeight: 295.28942

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=C(C4=CC=CC=C4N3)CC(=O)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=C(C4=CC=CC=C4N3)CC(=O)O

InChI

InChI=1S/C17H13NO4/c19-16(20)8-12-11-3-1-2-4-13(11)18-17(12)10-5-6-14-15(7-10)22-9-21-14/h1-7,18H,8-9H2,(H,19,20)