4-[[[1-(1-benzofuran-2-ylmethyl)-5-chloranyl-indol-7-yl]carbonylamino]methyl]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[[[1-(1-benzofuran-2-ylmethyl)-5-chloranyl-indol-7-yl]carbonylamino]methyl]cyclohexane-1-carboxylic acid Openeye Name: 4-[[[1-(benzofuran-2-ylmethyl)-5-chloro-indole-7-carbonyl]amino]methyl]cyclohexanecarboxylic acid CAS Name: 4-[[[[1-(2-benzofuranylmethyl)-5-chloro-7-indolyl]-oxomethyl]amino]methyl]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[[[1-(1-benzofuran-2-ylmethyl)-5-chloroindole-7-carbonyl]amino]methyl]cyclohexane-1-carboxylic acid Traditional Name: 4-[[[1-(benzofuran-2-ylmethyl)-5-chloro-indole-7-carbonyl]amino]methyl]cyclohexanecarboxylic acid Formula: C26H25ClN2O4 MolecularWeight: 464.9407

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CNC(=O)C2=C3C(=CC(=C2)Cl)C=CN3CC4=CC5=CC=CC=C5O4)C(=O)O

Isomeric SMILES

C1CC(CCC1CNC(=O)C2=C3C(=CC(=C2)Cl)C=CN3CC4=CC5=CC=CC=C5O4)C(=O)O

InChI

InChI=1S/C26H25ClN2O4/c27-20-11-19-9-10-29(15-21-12-18-3-1-2-4-23(18)33-21)24(19)22(13-20)25(30)28-14-16-5-7-17(8-6-16)26(31)32/h1-4,9-13,16-17H,5-8,14-15H2,(H,28,30)(H,31,32)