4-[(2-chloranyl-3,4-dimethoxy-phenyl)methyl]-1-cyclohexyl-6-oxidanyl-1,4-diazepan-2-one

Systemtic Name: 4-[(2-chloranyl-3,4-dimethoxy-phenyl)methyl]-1-cyclohexyl-6-oxidanyl-1,4-diazepan-2-one Openeye Name: 4-[(2-chloro-3,4-dimethoxy-phenyl)methyl]-1-cyclohexyl-6-hydroxy-1,4-diazepan-2-one CAS Name: 4-[(2-chloro-3,4-dimethoxyphenyl)methyl]-1-cyclohexyl-6-hydroxy-1,4-diazepan-2-one IUPAC Name: 4-[(2-chloro-3,4-dimethoxyphenyl)methyl]-1-cyclohexyl-6-hydroxy-1,4-diazepan-2-one Traditional Name: 4-(2-chloro-3,4-dimethoxy-benzyl)-1-cyclohexyl-6-hydroxy-1,4-diazepan-2-one Formula: C20H29ClN2O4 MolecularWeight: 396.90826

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CN2CC(CN(C(=O)C2)C3CCCCC3)O)Cl)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CN2CC(CN(C(=O)C2)C3CCCCC3)O)Cl)OC

InChI

InChI=1S/C20H29ClN2O4/c1-26-17-9-8-14(19(21)20(17)27-2)10-22-11-16(24)12-23(18(25)13-22)15-6-4-3-5-7-15/h8-9,15-16,24H,3-7,10-13H2,1-2H3