2-[5-methoxy-2-methyl-1-(3-phenethyloxyphenyl)carbonyl-indol-3-yl]ethanoic acid

Systemtic Name: 2-[5-methoxy-2-methyl-1-(3-phenethyloxyphenyl)carbonyl-indol-3-yl]ethanoic acid Openeye Name: 2-[5-methoxy-2-methyl-1-(3-phenethyloxybenzoyl)indol-3-yl]acetic acid CAS Name: 2-[5-methoxy-2-methyl-1-[oxo-(3-phenethyloxyphenyl)methyl]-3-indolyl]acetic acid IUPAC Name: 2-[5-methoxy-2-methyl-1-(3-phenethyloxybenzoyl)indol-3-yl]acetic acid Traditional Name: 2-[5-methoxy-2-methyl-1-(3-phenethyloxybenzoyl)indol-3-yl]acetic acid Formula: C27H25NO5 MolecularWeight: 443.4911

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C(=O)C3=CC(=CC=C3)OCCC4=CC=CC=C4)C=CC(=C2)OC)CC(=O)O

Isomeric SMILES

CC1=C(C2=C(N1C(=O)C3=CC(=CC=C3)OCCC4=CC=CC=C4)C=CC(=C2)OC)CC(=O)O

InChI

InChI=1S/C27H25NO5/c1-18-23(17-26(29)30)24-16-21(32-2)11-12-25(24)28(18)27(31)20-9-6-10-22(15-20)33-14-13-19-7-4-3-5-8-19/h3-12,15-16H,13-14,17H2,1-2H3,(H,29,30)