4-(4-cyclohexyl-3-oxidanylidene-6-phenylmethoxy-1,4-diazepan-1-yl)-4-oxidanylidene-butanamide

Systemtic Name: 4-(4-cyclohexyl-3-oxidanylidene-6-phenylmethoxy-1,4-diazepan-1-yl)-4-oxidanylidene-butanamide Openeye Name: 4-(6-benzyloxy-4-cyclohexyl-3-oxo-1,4-diazepan-1-yl)-4-oxo-butanamide CAS Name: 4-(4-cyclohexyl-3-oxo-6-phenylmethoxy-1,4-diazepan-1-yl)-4-oxobutanamide IUPAC Name: 4-(4-cyclohexyl-3-oxo-6-phenylmethoxy-1,4-diazepan-1-yl)-4-oxobutanamide Traditional Name: 4-(6-benzoxy-4-cyclohexyl-3-keto-1,4-diazepan-1-yl)-4-keto-butyramide Formula: C22H31N3O4 MolecularWeight: 401.49924

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CC(CN(CC2=O)C(=O)CCC(=O)N)OCC3=CC=CC=C3

Isomeric SMILES

C1CCC(CC1)N2CC(CN(CC2=O)C(=O)CCC(=O)N)OCC3=CC=CC=C3

InChI

InChI=1S/C22H31N3O4/c23-20(26)11-12-21(27)24-13-19(29-16-17-7-3-1-4-8-17)14-25(22(28)15-24)18-9-5-2-6-10-18/h1,3-4,7-8,18-19H,2,5-6,9-16H2,(H2,23,26)