2-[[4-(2,5-dimethoxyphenyl)carbonyl-2-oxidanylidene-1-phenethyl-1,4-diazepan-6-yl]oxy]-N,N-diethyl-ethanamide

Systemtic Name: 2-[[4-(2,5-dimethoxyphenyl)carbonyl-2-oxidanylidene-1-phenethyl-1,4-diazepan-6-yl]oxy]-N,N-diethyl-ethanamide Openeye Name: 2-[[4-(2,5-dimethoxybenzoyl)-2-oxo-1-phenethyl-1,4-diazepan-6-yl]oxy]-N,N-diethyl-acetamide CAS Name: 2-[[4-[(2,5-dimethoxyphenyl)-oxomethyl]-2-oxo-1-phenethyl-1,4-diazepan-6-yl]oxy]-N,N-diethylacetamide IUPAC Name: 2-[[4-(2,5-dimethoxybenzoyl)-2-oxo-1-phenethyl-1,4-diazepan-6-yl]oxy]-N,N-diethylacetamide Traditional Name: 2-[[4-(2,5-dimethoxybenzoyl)-2-keto-1-phenethyl-1,4-diazepan-6-yl]oxy]-N,N-diethyl-acetamide Formula: C28H37N3O6 MolecularWeight: 511.60988

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)COC1CN(CC(=O)N(C1)CCC2=CC=CC=C2)C(=O)C3=C(C=CC(=C3)OC)OC

Isomeric SMILES

CCN(CC)C(=O)COC1CN(CC(=O)N(C1)CCC2=CC=CC=C2)C(=O)C3=C(C=CC(=C3)OC)OC

InChI

InChI=1S/C28H37N3O6/c1-5-29(6-2)27(33)20-37-23-17-30(15-14-21-10-8-7-9-11-21)26(32)19-31(18-23)28(34)24-16-22(35-3)12-13-25(24)36-4/h7-13,16,23H,5-6,14-15,17-20H2,1-4H3