N-butyl-2-[(2S)-6-methanoyl-2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl]-N-methyl-ethanamide

Systemtic Name: N-butyl-2-[(2S)-6-methanoyl-2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl]-N-methyl-ethanamide Openeye Name: N-butyl-2-[(2S)-6-formyl-2-methyl-3-oxo-1,4-benzoxazin-4-yl]-N-methyl-acetamide CAS Name: N-butyl-2-[(2S)-6-formyl-2-methyl-3-oxo-1,4-benzoxazin-4-yl]-N-methylacetamide IUPAC Name: N-butyl-2-[(2S)-6-formyl-2-methyl-3-oxo-1,4-benzoxazin-4-yl]-N-methylacetamide Traditional Name: N-butyl-2-[(2S)-6-formyl-3-keto-2-methyl-1,4-benzoxazin-4-yl]-N-methyl-acetamide Formula: C17H22N2O4 MolecularWeight: 318.36758

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(=O)CN1C2=C(C=CC(=C2)C=O)OC(C1=O)C

Isomeric SMILES

CCCCN(C)C(=O)CN1C2=C(C=CC(=C2)C=O)O[C@H](C1=O)C

InChI

InChI=1S/C17H22N2O4/c1-4-5-8-18(3)16(21)10-19-14-9-13(11-20)6-7-15(14)23-12(2)17(19)22/h6-7,9,11-12H,4-5,8,10H2,1-3H3/t12-/m0/s1