methyl 6-[(E)-3-oxidanylidenebut-1-enyl]spiro[1,4-benzoxazine-2,1'-cyclopropane]-3-carboxylate

Systemtic Name: methyl 6-[(E)-3-oxidanylidenebut-1-enyl]spiro[1,4-benzoxazine-2,1'-cyclopropane]-3-carboxylate Openeye Name: methyl 6-[(E)-3-oxobut-1-enyl]spiro[1,4-benzoxazine-2,1'-cyclopropane]-3-carboxylate CAS Name: 6-[(E)-3-oxobut-1-enyl]-3-spiro[1,4-benzoxazine-2,1'-cyclopropane]carboxylic acid methyl ester IUPAC Name: methyl 6-[(E)-3-oxobut-1-enyl]spiro[1,4-benzoxazine-2,1'-cyclopropane]-3-carboxylate Traditional Name: 6-[(E)-3-ketobut-1-enyl]spiro[1,4-benzoxazine-2,1'-cyclopropane]-3-carboxylic acid methyl ester Formula: C16H15NO4 MolecularWeight: 285.2946

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C=CC1=CC2=C(C=C1)OC3(CC3)C(=N2)C(=O)OC

Isomeric SMILES

CC(=O)/C=C/C1=CC2=C(C=C1)OC3(CC3)C(=N2)C(=O)OC

InChI

InChI=1S/C16H15NO4/c1-10(18)3-4-11-5-6-13-12(9-11)17-14(15(19)20-2)16(21-13)7-8-16/h3-6,9H,7-8H2,1-2H3/b4-3+