[6-chloranyl-2-(4-methylphenyl)-4-oxidanylidene-chromen-3-yl] 3-phenylpropanoate

Systemtic Name: [6-chloranyl-2-(4-methylphenyl)-4-oxidanylidene-chromen-3-yl] 3-phenylpropanoate Openeye Name: [6-chloro-4-oxo-2-(p-tolyl)chromen-3-yl] 3-phenylpropanoate CAS Name: 3-phenylpropanoic acid [6-chloro-2-(4-methylphenyl)-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [6-chloro-2-(4-methylphenyl)-4-oxochromen-3-yl] 3-phenylpropanoate Traditional Name: 3-phenylpropionic acid [6-chloro-4-keto-2-(p-tolyl)chromen-3-yl] ester Formula: C25H19ClO4 MolecularWeight: 418.86896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=O)C3=C(O2)C=CC(=C3)Cl)OC(=O)CCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=O)C3=C(O2)C=CC(=C3)Cl)OC(=O)CCC4=CC=CC=C4

InChI

InChI=1S/C25H19ClO4/c1-16-7-10-18(11-8-16)24-25(23(28)20-15-19(26)12-13-21(20)29-24)30-22(27)14-9-17-5-3-2-4-6-17/h2-8,10-13,15H,9,14H2,1H3