2-[2-(3-ethoxycarbonyl-2-methyl-1-phenyl-indol-5-yl)oxyethanoylamino]benzoic acid

Systemtic Name: 2-[2-(3-ethoxycarbonyl-2-methyl-1-phenyl-indol-5-yl)oxyethanoylamino]benzoic acid Openeye Name: 2-[[2-(3-ethoxycarbonyl-2-methyl-1-phenyl-indol-5-yl)oxyacetyl]amino]benzoic acid CAS Name: 2-[[2-[(3-ethoxycarbonyl-2-methyl-1-phenyl-5-indolyl)oxy]-1-oxoethyl]amino]benzoic acid IUPAC Name: 2-[[2-(3-ethoxycarbonyl-2-methyl-1-phenylindol-5-yl)oxyacetyl]amino]benzoic acid Traditional Name: 2-[[2-(3-carbethoxy-2-methyl-1-phenyl-indol-5-yl)oxyacetyl]amino]benzoic acid Formula: C27H24N2O6 MolecularWeight: 472.48926

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC(=O)NC3=CC=CC=C3C(=O)O)C4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC(=O)NC3=CC=CC=C3C(=O)O)C4=CC=CC=C4)C

InChI

InChI=1S/C27H24N2O6/c1-3-34-27(33)25-17(2)29(18-9-5-4-6-10-18)23-14-13-19(15-21(23)25)35-16-24(30)28-22-12-8-7-11-20(22)26(31)32/h4-15H,3,16H2,1-2H3,(H,28,30)(H,31,32)