N-[4-(6,7-dimethoxy-4-oxidanylidene-3,1-benzoxazin-2-yl)phenyl]-3-methyl-butanamide

Systemtic Name: N-[4-(6,7-dimethoxy-4-oxidanylidene-3,1-benzoxazin-2-yl)phenyl]-3-methyl-butanamide Openeye Name: N-[4-(6,7-dimethoxy-4-oxo-3,1-benzoxazin-2-yl)phenyl]-3-methyl-butanamide CAS Name: N-[4-(6,7-dimethoxy-4-oxo-3,1-benzoxazin-2-yl)phenyl]-3-methylbutanamide IUPAC Name: N-[4-(6,7-dimethoxy-4-oxo-3,1-benzoxazin-2-yl)phenyl]-3-methylbutanamide Traditional Name: N-[4-(4-keto-6,7-dimethoxy-3,1-benzoxazin-2-yl)phenyl]-3-methyl-butyramide Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)C2=NC3=CC(=C(C=C3C(=O)O2)OC)OC

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)C2=NC3=CC(=C(C=C3C(=O)O2)OC)OC

InChI

InChI=1S/C21H22N2O5/c1-12(2)9-19(24)22-14-7-5-13(6-8-14)20-23-16-11-18(27-4)17(26-3)10-15(16)21(25)28-20/h5-8,10-12H,9H2,1-4H3,(H,22,24)