(6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl 4-cyanobenzoate

Systemtic Name: (6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl 4-cyanobenzoate Openeye Name: (6-chloro-7-methyl-2-oxo-chromen-4-yl)methyl 4-cyanobenzoate CAS Name: 4-cyanobenzoic acid (6-chloro-7-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6-chloro-7-methyl-2-oxochromen-4-yl)methyl 4-cyanobenzoate Traditional Name: 4-cyanobenzoic acid (6-chloro-2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C19H12ClNO4 MolecularWeight: 353.75588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C3=CC=C(C=C3)C#N)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C3=CC=C(C=C3)C#N)Cl

InChI

InChI=1S/C19H12ClNO4/c1-11-6-17-15(8-16(11)20)14(7-18(22)25-17)10-24-19(23)13-4-2-12(9-21)3-5-13/h2-8H,10H2,1H3