1-(4-butoxyphenyl)carbonyl-5-methoxy-2-methyl-indole-3-carboxylic acid

Systemtic Name: 1-(4-butoxyphenyl)carbonyl-5-methoxy-2-methyl-indole-3-carboxylic acid Openeye Name: 1-(4-butoxybenzoyl)-5-methoxy-2-methyl-indole-3-carboxylic acid CAS Name: 1-[(4-butoxyphenyl)-oxomethyl]-5-methoxy-2-methyl-3-indolecarboxylic acid IUPAC Name: 1-(4-butoxybenzoyl)-5-methoxy-2-methylindole-3-carboxylic acid Traditional Name: 1-(4-butoxybenzoyl)-5-methoxy-2-methyl-indole-3-carboxylic acid Formula: C22H23NO5 MolecularWeight: 381.42172

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23NO5/c1-4-5-12-28-16-8-6-15(7-9-16)21(24)23-14(2)20(22(25)26)18-13-17(27-3)10-11-19(18)23/h6-11,13H,4-5,12H2,1-3H3,(H,25,26)