3-[3-(4-methoxyphenyl)-3-oxidanyl-2-oxidanylidene-butyl]-1,4-diazepan-2-one

Systemtic Name: 3-[3-(4-methoxyphenyl)-3-oxidanyl-2-oxidanylidene-butyl]-1,4-diazepan-2-one Openeye Name: 3-[3-hydroxy-3-(4-methoxyphenyl)-2-oxo-butyl]-1,4-diazepan-2-one CAS Name: 3-[3-hydroxy-3-(4-methoxyphenyl)-2-oxobutyl]-1,4-diazepan-2-one IUPAC Name: 3-[3-hydroxy-3-(4-methoxyphenyl)-2-oxobutyl]-1,4-diazepan-2-one Traditional Name: 3-[3-hydroxy-2-keto-3-(4-methoxyphenyl)butyl]-1,4-diazepan-2-one Formula: C16H22N2O4 MolecularWeight: 306.35688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)OC)(C(=O)CC2C(=O)NCCCN2)O

Isomeric SMILES

CC(C1=CC=C(C=C1)OC)(C(=O)CC2C(=O)NCCCN2)O

InChI

InChI=1S/C16H22N2O4/c1-16(21,11-4-6-12(22-2)7-5-11)14(19)10-13-15(20)18-9-3-8-17-13/h4-7,13,17,21H,3,8-10H2,1-2H3,(H,18,20)