2-[2-(3,4-diethoxyphenyl)-4,6-dimethyl-1H-indol-3-yl]ethanoic acid

Systemtic Name: 2-[2-(3,4-diethoxyphenyl)-4,6-dimethyl-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[2-(3,4-diethoxyphenyl)-4,6-dimethyl-1H-indol-3-yl]acetic acid CAS Name: 2-[2-(3,4-diethoxyphenyl)-4,6-dimethyl-1H-indol-3-yl]acetic acid IUPAC Name: 2-[2-(3,4-diethoxyphenyl)-4,6-dimethyl-1H-indol-3-yl]acetic acid Traditional Name: 2-[2-(3,4-diethoxyphenyl)-4,6-dimethyl-1H-indol-3-yl]acetic acid Formula: C22H25NO4 MolecularWeight: 367.4382

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=C(C3=C(C=C(C=C3N2)C)C)CC(=O)O)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=C(C3=C(C=C(C=C3N2)C)C)CC(=O)O)OCC

InChI

InChI=1S/C22H25NO4/c1-5-26-18-8-7-15(11-19(18)27-6-2)22-16(12-20(24)25)21-14(4)9-13(3)10-17(21)23-22/h7-11,23H,5-6,12H2,1-4H3,(H,24,25)