methyl 4-[(2Z)-3-chloranyl-2-(dimethylaminomethylidene)-1,4-benzoxazin-7-yl]-3-methyl-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-[(2Z)-3-chloranyl-2-(dimethylaminomethylidene)-1,4-benzoxazin-7-yl]-3-methyl-4-oxidanylidene-butanoate Openeye Name: methyl 4-[(2Z)-3-chloro-2-(dimethylaminomethylene)-1,4-benzoxazin-7-yl]-3-methyl-4-oxo-butanoate CAS Name: 4-[(2Z)-3-chloro-2-(dimethylaminomethylidene)-1,4-benzoxazin-7-yl]-3-methyl-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[(2Z)-3-chloro-2-(dimethylaminomethylidene)-1,4-benzoxazin-7-yl]-3-methyl-4-oxobutanoate Traditional Name: 4-[(2Z)-3-chloro-2-(dimethylaminomethylene)-1,4-benzoxazin-7-yl]-4-keto-3-methyl-butyric acid methyl ester Formula: C17H19ClN2O4 MolecularWeight: 350.79676

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OC)C(=O)C1=CC2=C(C=C1)N=C(C(=CN(C)C)O2)Cl

Isomeric SMILES

CC(CC(=O)OC)C(=O)C1=CC2=C(C=C1)N=C(/C(=C/N(C)C)/O2)Cl

InChI

InChI=1S/C17H19ClN2O4/c1-10(7-15(21)23-4)16(22)11-5-6-12-13(8-11)24-14(9-20(2)3)17(18)19-12/h5-6,8-10H,7H2,1-4H3/b14-9-