4-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-6-ethanoyl-2,2-dimethyl-1,4-benzoxazin-3-one

Systemtic Name: 4-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-6-ethanoyl-2,2-dimethyl-1,4-benzoxazin-3-one Openeye Name: 6-acetyl-4-[2-(azepan-1-yl)-2-oxo-ethyl]-2,2-dimethyl-1,4-benzoxazin-3-one CAS Name: 6-acetyl-4-[2-(1-azepanyl)-2-oxoethyl]-2,2-dimethyl-1,4-benzoxazin-3-one IUPAC Name: 6-acetyl-4-[2-(azepan-1-yl)-2-oxoethyl]-2,2-dimethyl-1,4-benzoxazin-3-one Traditional Name: 6-acetyl-4-[2-(azepan-1-yl)-2-keto-ethyl]-2,2-dimethyl-1,4-benzoxazin-3-one Formula: C20H26N2O4 MolecularWeight: 358.43144

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)OC(C(=O)N2CC(=O)N3CCCCCC3)(C)C

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)OC(C(=O)N2CC(=O)N3CCCCCC3)(C)C

InChI

InChI=1S/C20H26N2O4/c1-14(23)15-8-9-17-16(12-15)22(19(25)20(2,3)26-17)13-18(24)21-10-6-4-5-7-11-21/h8-9,12H,4-7,10-11,13H2,1-3H3