methyl 5-[[4-chloranyl-3-(2-methoxyethoxy)-1-oxidanylidene-isochromen-7-yl]amino]-5-oxidanylidene-pentanoate

Systemtic Name: methyl 5-[[4-chloranyl-3-(2-methoxyethoxy)-1-oxidanylidene-isochromen-7-yl]amino]-5-oxidanylidene-pentanoate Openeye Name: methyl 5-[[4-chloro-3-(2-methoxyethoxy)-1-oxo-isochromen-7-yl]amino]-5-oxo-pentanoate CAS Name: 5-[[4-chloro-3-(2-methoxyethoxy)-1-oxo-2-benzopyran-7-yl]amino]-5-oxopentanoic acid methyl ester IUPAC Name: methyl 5-[[4-chloro-3-(2-methoxyethoxy)-1-oxoisochromen-7-yl]amino]-5-oxopentanoate Traditional Name: 5-[[4-chloro-1-keto-3-(2-methoxyethoxy)isochromen-7-yl]amino]-5-keto-valeric acid methyl ester Formula: C18H20ClNO7 MolecularWeight: 397.8069

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C2=C(C=C(C=C2)NC(=O)CCCC(=O)OC)C(=O)O1)Cl

Isomeric SMILES

COCCOC1=C(C2=C(C=C(C=C2)NC(=O)CCCC(=O)OC)C(=O)O1)Cl

InChI

InChI=1S/C18H20ClNO7/c1-24-8-9-26-18-16(19)12-7-6-11(10-13(12)17(23)27-18)20-14(21)4-3-5-15(22)25-2/h6-7,10H,3-5,8-9H2,1-2H3,(H,20,21)