methyl 4-butyl-2,2-dimethyl-3-oxidanylidene-1,4-benzoxazine-6-carboxylate

Systemtic Name: methyl 4-butyl-2,2-dimethyl-3-oxidanylidene-1,4-benzoxazine-6-carboxylate Openeye Name: methyl 4-butyl-2,2-dimethyl-3-oxo-1,4-benzoxazine-6-carboxylate CAS Name: 4-butyl-2,2-dimethyl-3-oxo-1,4-benzoxazine-6-carboxylic acid methyl ester IUPAC Name: methyl 4-butyl-2,2-dimethyl-3-oxo-1,4-benzoxazine-6-carboxylate Traditional Name: 4-butyl-3-keto-2,2-dimethyl-1,4-benzoxazine-6-carboxylic acid methyl ester Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=CC(=C2)C(=O)OC)OC(C1=O)(C)C

Isomeric SMILES

CCCCN1C2=C(C=CC(=C2)C(=O)OC)OC(C1=O)(C)C

InChI

InChI=1S/C16H21NO4/c1-5-6-9-17-12-10-11(14(18)20-4)7-8-13(12)21-16(2,3)15(17)19/h7-8,10H,5-6,9H2,1-4H3