2-[(5-chloranylpyridin-2-yl)carbamoyl]-3-[(4-morpholin-4-ylcyclohexyl)carbonylamino]-1-benzofuran-5-carboxylic acid

Systemtic Name: 2-[(5-chloranylpyridin-2-yl)carbamoyl]-3-[(4-morpholin-4-ylcyclohexyl)carbonylamino]-1-benzofuran-5-carboxylic acid Openeye Name: 2-[(5-chloro-2-pyridyl)carbamoyl]-3-[(4-morpholinocyclohexanecarbonyl)amino]benzofuran-5-carboxylic acid CAS Name: 2-[[(5-chloro-2-pyridinyl)amino]-oxomethyl]-3-[[[4-(4-morpholinyl)cyclohexyl]-oxomethyl]amino]-5-benzofurancarboxylic acid IUPAC Name: 2-[(5-chloropyridin-2-yl)carbamoyl]-3-[(4-morpholin-4-ylcyclohexanecarbonyl)amino]-1-benzofuran-5-carboxylic acid Traditional Name: 2-[(5-chloro-2-pyridyl)carbamoyl]-3-[(4-morpholinocyclohexanecarbonyl)amino]benzofuran-5-carboxylic acid Formula: C26H27ClN4O6 MolecularWeight: 526.96878

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C(=O)NC2=C(OC3=C2C=C(C=C3)C(=O)O)C(=O)NC4=NC=C(C=C4)Cl)N5CCOCC5

Isomeric SMILES

C1CC(CCC1C(=O)NC2=C(OC3=C2C=C(C=C3)C(=O)O)C(=O)NC4=NC=C(C=C4)Cl)N5CCOCC5

InChI

InChI=1S/C26H27ClN4O6/c27-17-4-8-21(28-14-17)29-25(33)23-22(19-13-16(26(34)35)3-7-20(19)37-23)30-24(32)15-1-5-18(6-2-15)31-9-11-36-12-10-31/h3-4,7-8,13-15,18H,1-2,5-6,9-12H2,(H,30,32)(H,34,35)(H,28,29,33)