[5-chloranyl-2-oxidanylidene-3-(phenylmethyl)chromen-4-yl] 4-methylbenzoate

Systemtic Name: [5-chloranyl-2-oxidanylidene-3-(phenylmethyl)chromen-4-yl] 4-methylbenzoate Openeye Name: (3-benzyl-5-chloro-2-oxo-chromen-4-yl) 4-methylbenzoate CAS Name: 4-methylbenzoic acid [5-chloro-2-oxo-3-(phenylmethyl)-1-benzopyran-4-yl] ester IUPAC Name: (3-benzyl-5-chloro-2-oxochromen-4-yl) 4-methylbenzoate Traditional Name: 4-methylbenzoic acid (3-benzyl-5-chloro-2-keto-chromen-4-yl) ester Formula: C24H17ClO4 MolecularWeight: 404.84238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=C(C(=O)OC3=C2C(=CC=C3)Cl)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2=C(C(=O)OC3=C2C(=CC=C3)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C24H17ClO4/c1-15-10-12-17(13-11-15)23(26)29-22-18(14-16-6-3-2-4-7-16)24(27)28-20-9-5-8-19(25)21(20)22/h2-13H,14H2,1H3