2-(azepan-2-yl)-2-(6-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanal

Systemtic Name: 2-(azepan-2-yl)-2-(6-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanal Openeye Name: 2-(azepan-2-yl)-2-(6-methyl-3-oxo-1,4-benzoxazin-4-yl)acetaldehyde CAS Name: 2-(2-azepanyl)-2-(6-methyl-3-oxo-1,4-benzoxazin-4-yl)acetaldehyde IUPAC Name: 2-(azepan-2-yl)-2-(6-methyl-3-oxo-1,4-benzoxazin-4-yl)acetaldehyde Traditional Name: 2-(azepan-2-yl)-2-(3-keto-6-methyl-1,4-benzoxazin-4-yl)acetaldehyde Formula: C17H22N2O3 MolecularWeight: 302.36818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OCC(=O)N2C(C=O)C3CCCCCN3

Isomeric SMILES

CC1=CC2=C(C=C1)OCC(=O)N2C(C=O)C3CCCCCN3

InChI

InChI=1S/C17H22N2O3/c1-12-6-7-16-14(9-12)19(17(21)11-22-16)15(10-20)13-5-3-2-4-8-18-13/h6-7,9-10,13,15,18H,2-5,8,11H2,1H3