2-[1-(3-butoxyphenyl)carbonyl-2-methyl-indol-4-yl]ethanoic acid

Systemtic Name: 2-[1-(3-butoxyphenyl)carbonyl-2-methyl-indol-4-yl]ethanoic acid Openeye Name: 2-[1-(3-butoxybenzoyl)-2-methyl-indol-4-yl]acetic acid CAS Name: 2-[1-[(3-butoxyphenyl)-oxomethyl]-2-methyl-4-indolyl]acetic acid IUPAC Name: 2-[1-(3-butoxybenzoyl)-2-methylindol-4-yl]acetic acid Traditional Name: 2-[1-(3-butoxybenzoyl)-2-methyl-indol-4-yl]acetic acid Formula: C22H23NO4 MolecularWeight: 365.42232

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)N2C(=CC3=C(C=CC=C32)CC(=O)O)C

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)N2C(=CC3=C(C=CC=C32)CC(=O)O)C

InChI

InChI=1S/C22H23NO4/c1-3-4-11-27-18-9-5-8-17(13-18)22(26)23-15(2)12-19-16(14-21(24)25)7-6-10-20(19)23/h5-10,12-13H,3-4,11,14H2,1-2H3,(H,24,25)