2-[[7-[(6-chloranylpyridin-3-yl)carbonylamino]-1H-indol-2-yl]carbonylamino]-5-cyano-benzoic acid

Systemtic Name: 2-[[7-[(6-chloranylpyridin-3-yl)carbonylamino]-1H-indol-2-yl]carbonylamino]-5-cyano-benzoic acid Openeye Name: 2-[[7-[(6-chloropyridine-3-carbonyl)amino]-1H-indole-2-carbonyl]amino]-5-cyano-benzoic acid CAS Name: 2-[[[7-[[(6-chloro-3-pyridinyl)-oxomethyl]amino]-1H-indol-2-yl]-oxomethyl]amino]-5-cyanobenzoic acid IUPAC Name: 2-[[7-[(6-chloropyridine-3-carbonyl)amino]-1H-indole-2-carbonyl]amino]-5-cyanobenzoic acid Traditional Name: 2-[[7-[(6-chloronicotinoyl)amino]-1H-indole-2-carbonyl]amino]-5-cyano-benzoic acid Formula: C23H14ClN5O4 MolecularWeight: 459.84136

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)NC(=O)C3=CN=C(C=C3)Cl)NC(=C2)C(=O)NC4=C(C=C(C=C4)C#N)C(=O)O

Isomeric SMILES

C1=CC2=C(C(=C1)NC(=O)C3=CN=C(C=C3)Cl)NC(=C2)C(=O)NC4=C(C=C(C=C4)C#N)C(=O)O

InChI

InChI=1S/C23H14ClN5O4/c24-19-7-5-14(11-26-19)21(30)29-17-3-1-2-13-9-18(27-20(13)17)22(31)28-16-6-4-12(10-25)8-15(16)23(32)33/h1-9,11,27H,(H,28,31)(H,29,30)(H,32,33)