[6-chloranyl-2-(furan-2-yl)-7-methyl-4-oxidanylidene-chromen-3-yl] 4-methylbenzoate

Systemtic Name: [6-chloranyl-2-(furan-2-yl)-7-methyl-4-oxidanylidene-chromen-3-yl] 4-methylbenzoate Openeye Name: [6-chloro-2-(2-furyl)-7-methyl-4-oxo-chromen-3-yl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [6-chloro-2-(2-furanyl)-7-methyl-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [6-chloro-2-(furan-2-yl)-7-methyl-4-oxochromen-3-yl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [6-chloro-2-(2-furyl)-4-keto-7-methyl-chromen-3-yl] ester Formula: C22H15ClO5 MolecularWeight: 394.8045

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=C(OC3=CC(=C(C=C3C2=O)Cl)C)C4=CC=CO4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2=C(OC3=CC(=C(C=C3C2=O)Cl)C)C4=CC=CO4

InChI

InChI=1S/C22H15ClO5/c1-12-5-7-14(8-6-12)22(25)28-21-19(24)15-11-16(23)13(2)10-18(15)27-20(21)17-4-3-9-26-17/h3-11H,1-2H3