5-oxidanylidene-4-[1-oxidanylidene-1-(4-oxidanylpiperidin-1-yl)propan-2-yl]-2,3-dihydro-1,4-benzoxazepine-8-carbonitrile

Systemtic Name: 5-oxidanylidene-4-[1-oxidanylidene-1-(4-oxidanylpiperidin-1-yl)propan-2-yl]-2,3-dihydro-1,4-benzoxazepine-8-carbonitrile Openeye Name: 4-[2-(4-hydroxy-1-piperidyl)-1-methyl-2-oxo-ethyl]-5-oxo-2,3-dihydro-1,4-benzoxazepine-8-carbonitrile CAS Name: 4-[1-(4-hydroxy-1-piperidinyl)-1-oxopropan-2-yl]-5-oxo-2,3-dihydro-1,4-benzoxazepine-8-carbonitrile IUPAC Name: 4-[1-(4-hydroxypiperidin-1-yl)-1-oxopropan-2-yl]-5-oxo-2,3-dihydro-1,4-benzoxazepine-8-carbonitrile Traditional Name: 4-[2-(4-hydroxypiperidino)-2-keto-1-methyl-ethyl]-5-keto-2,3-dihydro-1,4-benzoxazepine-8-carbonitrile Formula: C18H21N3O4 MolecularWeight: 343.37704

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC(CC1)O)N2CCOC3=C(C2=O)C=CC(=C3)C#N

Isomeric SMILES

CC(C(=O)N1CCC(CC1)O)N2CCOC3=C(C2=O)C=CC(=C3)C#N

InChI

InChI=1S/C18H21N3O4/c1-12(17(23)20-6-4-14(22)5-7-20)21-8-9-25-16-10-13(11-19)2-3-15(16)18(21)24/h2-3,10,12,14,22H,4-9H2,1H3