(6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl 3-(4-methoxyphenyl)propanoate

Systemtic Name: (6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl 3-(4-methoxyphenyl)propanoate Openeye Name: (6-chloro-7-methyl-2-oxo-chromen-4-yl)methyl 3-(4-methoxyphenyl)propanoate CAS Name: 3-(4-methoxyphenyl)propanoic acid (6-chloro-7-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6-chloro-7-methyl-2-oxochromen-4-yl)methyl 3-(4-methoxyphenyl)propanoate Traditional Name: 3-(4-methoxyphenyl)propionic acid (6-chloro-2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C21H19ClO5 MolecularWeight: 386.82556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)CCC3=CC=C(C=C3)OC)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)CCC3=CC=C(C=C3)OC)Cl

InChI

InChI=1S/C21H19ClO5/c1-13-9-19-17(11-18(13)22)15(10-21(24)27-19)12-26-20(23)8-5-14-3-6-16(25-2)7-4-14/h3-4,6-7,9-11H,5,8,12H2,1-2H3