2-[1-[2-(4-methoxyphenyl)ethyl]-5-prop-2-enoxy-indol-3-yl]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[1-[2-(4-methoxyphenyl)ethyl]-5-prop-2-enoxy-indol-3-yl]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[5-allyloxy-1-[2-(4-methoxyphenyl)ethyl]indol-3-yl]-2-oxo-acetic acid CAS Name: 2-[1-[2-(4-methoxyphenyl)ethyl]-5-prop-2-enoxy-3-indolyl]-2-oxoacetic acid IUPAC Name: 2-[1-[2-(4-methoxyphenyl)ethyl]-5-prop-2-enoxyindol-3-yl]-2-oxoacetic acid Traditional Name: 2-[5-allyloxy-1-[2-(4-methoxyphenyl)ethyl]indol-3-yl]-2-keto-acetic acid Formula: C22H21NO5 MolecularWeight: 379.40584

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCN2C=C(C3=C2C=CC(=C3)OCC=C)C(=O)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)CCN2C=C(C3=C2C=CC(=C3)OCC=C)C(=O)C(=O)O

InChI

InChI=1S/C22H21NO5/c1-3-12-28-17-8-9-20-18(13-17)19(21(24)22(25)26)14-23(20)11-10-15-4-6-16(27-2)7-5-15/h3-9,13-14H,1,10-12H2,2H3,(H,25,26)