4-(azepan-1-ylmethyl)-N-(3-chloranyl-2-methyl-phenyl)-2-methyl-5-oxidanyl-1-benzofuran-3-carboxamide

Systemtic Name: 4-(azepan-1-ylmethyl)-N-(3-chloranyl-2-methyl-phenyl)-2-methyl-5-oxidanyl-1-benzofuran-3-carboxamide Openeye Name: 4-(azepan-1-ylmethyl)-N-(3-chloro-2-methyl-phenyl)-5-hydroxy-2-methyl-benzofuran-3-carboxamide CAS Name: 4-(1-azepanylmethyl)-N-(3-chloro-2-methylphenyl)-5-hydroxy-2-methyl-3-benzofurancarboxamide IUPAC Name: 4-(azepan-1-ylmethyl)-N-(3-chloro-2-methylphenyl)-5-hydroxy-2-methyl-1-benzofuran-3-carboxamide Traditional Name: 4-(azepan-1-ylmethyl)-N-(3-chloro-2-methyl-phenyl)-5-hydroxy-2-methyl-benzofuran-3-carboxamide Formula: C24H27ClN2O3 MolecularWeight: 426.93578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)C2=C(OC3=C2C(=C(C=C3)O)CN4CCCCCC4)C

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)C2=C(OC3=C2C(=C(C=C3)O)CN4CCCCCC4)C

InChI

InChI=1S/C24H27ClN2O3/c1-15-18(25)8-7-9-19(15)26-24(29)22-16(2)30-21-11-10-20(28)17(23(21)22)14-27-12-5-3-4-6-13-27/h7-11,28H,3-6,12-14H2,1-2H3,(H,26,29)