2-[5-methoxy-2-methyl-1-(4-propoxyphenyl)carbonyl-indol-3-yl]ethanoic acid

Systemtic Name: 2-[5-methoxy-2-methyl-1-(4-propoxyphenyl)carbonyl-indol-3-yl]ethanoic acid Openeye Name: 2-[5-methoxy-2-methyl-1-(4-propoxybenzoyl)indol-3-yl]acetic acid CAS Name: 2-[5-methoxy-2-methyl-1-[oxo-(4-propoxyphenyl)methyl]-3-indolyl]acetic acid IUPAC Name: 2-[5-methoxy-2-methyl-1-(4-propoxybenzoyl)indol-3-yl]acetic acid Traditional Name: 2-[5-methoxy-2-methyl-1-(4-propoxybenzoyl)indol-3-yl]acetic acid Formula: C22H23NO5 MolecularWeight: 381.42172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)N2C(=C(C3=C2C=CC(=C3)OC)CC(=O)O)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)N2C(=C(C3=C2C=CC(=C3)OC)CC(=O)O)C

InChI

InChI=1S/C22H23NO5/c1-4-11-28-16-7-5-15(6-8-16)22(26)23-14(2)18(13-21(24)25)19-12-17(27-3)9-10-20(19)23/h5-10,12H,4,11,13H2,1-3H3,(H,24,25)