methyl 5-[(4-chloranyl-3-methoxy-1-oxidanylidene-isochromen-7-yl)amino]-5-oxidanylidene-pentanoate

Systemtic Name: methyl 5-[(4-chloranyl-3-methoxy-1-oxidanylidene-isochromen-7-yl)amino]-5-oxidanylidene-pentanoate Openeye Name: methyl 5-[(4-chloro-3-methoxy-1-oxo-isochromen-7-yl)amino]-5-oxo-pentanoate CAS Name: 5-[(4-chloro-3-methoxy-1-oxo-2-benzopyran-7-yl)amino]-5-oxopentanoic acid methyl ester IUPAC Name: methyl 5-[(4-chloro-3-methoxy-1-oxoisochromen-7-yl)amino]-5-oxopentanoate Traditional Name: 5-[(4-chloro-1-keto-3-methoxy-isochromen-7-yl)amino]-5-keto-valeric acid methyl ester Formula: C16H16ClNO6 MolecularWeight: 353.75434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16ClNO6/c1-22-13(20)5-3-4-12(19)18-9-6-7-10-11(8-9)15(21)24-16(23-2)14(10)17/h6-8H,3-5H2,1-2H3,(H,18,19)