5-cyano-2-[[7-[2-(4-methoxyphenyl)ethanoylamino]-1H-indol-2-yl]carbonylamino]benzoic acid

Systemtic Name: 5-cyano-2-[[7-[2-(4-methoxyphenyl)ethanoylamino]-1H-indol-2-yl]carbonylamino]benzoic acid Openeye Name: 5-cyano-2-[[7-[[2-(4-methoxyphenyl)acetyl]amino]-1H-indole-2-carbonyl]amino]benzoic acid CAS Name: 5-cyano-2-[[[7-[[2-(4-methoxyphenyl)-1-oxoethyl]amino]-1H-indol-2-yl]-oxomethyl]amino]benzoic acid IUPAC Name: 5-cyano-2-[[7-[[2-(4-methoxyphenyl)acetyl]amino]-1H-indole-2-carbonyl]amino]benzoic acid Traditional Name: 5-cyano-2-[[7-[[2-(4-methoxyphenyl)acetyl]amino]-1H-indole-2-carbonyl]amino]benzoic acid Formula: C26H20N4O5 MolecularWeight: 468.4608

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(=O)NC2=CC=CC3=C2NC(=C3)C(=O)NC4=C(C=C(C=C4)C#N)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)CC(=O)NC2=CC=CC3=C2NC(=C3)C(=O)NC4=C(C=C(C=C4)C#N)C(=O)O

InChI

InChI=1S/C26H20N4O5/c1-35-18-8-5-15(6-9-18)12-23(31)28-21-4-2-3-17-13-22(29-24(17)21)25(32)30-20-10-7-16(14-27)11-19(20)26(33)34/h2-11,13,29H,12H2,1H3,(H,28,31)(H,30,32)(H,33,34)