4-[[5-[2-(butylamino)-2-oxidanylidene-ethyl]-1-methyl-indol-3-yl]methyl]-3-methoxy-benzoic acid

Systemtic Name: 4-[[5-[2-(butylamino)-2-oxidanylidene-ethyl]-1-methyl-indol-3-yl]methyl]-3-methoxy-benzoic acid Openeye Name: 4-[[5-[2-(butylamino)-2-oxo-ethyl]-1-methyl-indol-3-yl]methyl]-3-methoxy-benzoic acid CAS Name: 4-[[5-[2-(butylamino)-2-oxoethyl]-1-methyl-3-indolyl]methyl]-3-methoxybenzoic acid IUPAC Name: 4-[[5-[2-(butylamino)-2-oxoethyl]-1-methylindol-3-yl]methyl]-3-methoxybenzoic acid Traditional Name: 4-[[5-[2-(butylamino)-2-keto-ethyl]-1-methyl-indol-3-yl]methyl]-3-methoxy-benzoic acid Formula: C24H28N2O4 MolecularWeight: 408.49012

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CC1=CC2=C(C=C1)N(C=C2CC3=C(C=C(C=C3)C(=O)O)OC)C

Isomeric SMILES

CCCCNC(=O)CC1=CC2=C(C=C1)N(C=C2CC3=C(C=C(C=C3)C(=O)O)OC)C

InChI

InChI=1S/C24H28N2O4/c1-4-5-10-25-23(27)12-16-6-9-21-20(11-16)19(15-26(21)2)13-17-7-8-18(24(28)29)14-22(17)30-3/h6-9,11,14-15H,4-5,10,12-13H2,1-3H3,(H,25,27)(H,28,29)