methyl 4-[(4-chloranyl-3-methoxy-1-oxidanylidene-isochromen-7-yl)amino]-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-[(4-chloranyl-3-methoxy-1-oxidanylidene-isochromen-7-yl)amino]-4-oxidanylidene-butanoate Openeye Name: methyl 4-[(4-chloro-3-methoxy-1-oxo-isochromen-7-yl)amino]-4-oxo-butanoate CAS Name: 4-[(4-chloro-3-methoxy-1-oxo-2-benzopyran-7-yl)amino]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[(4-chloro-3-methoxy-1-oxoisochromen-7-yl)amino]-4-oxobutanoate Traditional Name: 4-[(4-chloro-1-keto-3-methoxy-isochromen-7-yl)amino]-4-keto-butyric acid methyl ester Formula: C15H14ClNO6 MolecularWeight: 339.72776

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C(C=C2)NC(=O)CCC(=O)OC)C(=O)O1)Cl

Isomeric SMILES

COC1=C(C2=C(C=C(C=C2)NC(=O)CCC(=O)OC)C(=O)O1)Cl

InChI

InChI=1S/C15H14ClNO6/c1-21-12(19)6-5-11(18)17-8-3-4-9-10(7-8)14(20)23-15(22-2)13(9)16/h3-4,7H,5-6H2,1-2H3,(H,17,18)