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

Systemtic Name: 4-[1-(4-butoxyphenyl)carbonyl-5-methoxy-2-methyl-indol-3-yl]butanoic acid Openeye Name: 4-[1-(4-butoxybenzoyl)-5-methoxy-2-methyl-indol-3-yl]butanoic acid CAS Name: 4-[1-[(4-butoxyphenyl)-oxomethyl]-5-methoxy-2-methyl-3-indolyl]butanoic acid IUPAC Name: 4-[1-(4-butoxybenzoyl)-5-methoxy-2-methylindol-3-yl]butanoic acid Traditional Name: 4-[1-(4-butoxybenzoyl)-5-methoxy-2-methyl-indol-3-yl]butyric acid Formula: C25H29NO5 MolecularWeight: 423.50146

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)N2C(=C(C3=C2C=CC(=C3)OC)CCCC(=O)O)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)N2C(=C(C3=C2C=CC(=C3)OC)CCCC(=O)O)C

InChI

InChI=1S/C25H29NO5/c1-4-5-15-31-19-11-9-18(10-12-19)25(29)26-17(2)21(7-6-8-24(27)28)22-16-20(30-3)13-14-23(22)26/h9-14,16H,4-8,15H2,1-3H3,(H,27,28)