1-[1-[(3-methoxyphenyl)methyl]-6-oxidanylidene-piperidin-3-yl]carbonyl-1,4-diazepan-5-one

Systemtic Name: 1-[1-[(3-methoxyphenyl)methyl]-6-oxidanylidene-piperidin-3-yl]carbonyl-1,4-diazepan-5-one Openeye Name: 1-[1-[(3-methoxyphenyl)methyl]-6-oxo-piperidine-3-carbonyl]-1,4-diazepan-5-one CAS Name: 1-[[1-[(3-methoxyphenyl)methyl]-6-oxo-3-piperidinyl]-oxomethyl]-1,4-diazepan-5-one IUPAC Name: 1-[1-[(3-methoxyphenyl)methyl]-6-oxopiperidine-3-carbonyl]-1,4-diazepan-5-one Traditional Name: 1-(6-keto-1-m-anisyl-nipecotoyl)-1,4-diazepan-5-one Formula: C19H25N3O4 MolecularWeight: 359.4195

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN2CC(CCC2=O)C(=O)N3CCC(=O)NCC3

Isomeric SMILES

COC1=CC=CC(=C1)CN2CC(CCC2=O)C(=O)N3CCC(=O)NCC3

InChI

InChI=1S/C19H25N3O4/c1-26-16-4-2-3-14(11-16)12-22-13-15(5-6-18(22)24)19(25)21-9-7-17(23)20-8-10-21/h2-4,11,15H,5-10,12-13H2,1H3,(H,20,23)