[3-(4-chlorophenyl)-4-oxidanylidene-chromen-7-yl] 4-(2-methylphenoxy)butanoate

Systemtic Name: [3-(4-chlorophenyl)-4-oxidanylidene-chromen-7-yl] 4-(2-methylphenoxy)butanoate Openeye Name: [3-(4-chlorophenyl)-4-oxo-chromen-7-yl] 4-(2-methylphenoxy)butanoate CAS Name: 4-(2-methylphenoxy)butanoic acid [3-(4-chlorophenyl)-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(4-chlorophenyl)-4-oxochromen-7-yl] 4-(2-methylphenoxy)butanoate Traditional Name: 4-(2-methylphenoxy)butyric acid [3-(4-chlorophenyl)-4-keto-chromen-7-yl] ester Formula: C26H21ClO5 MolecularWeight: 448.89494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCCCC(=O)OC2=CC3=C(C=C2)C(=O)C(=CO3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC=CC=C1OCCCC(=O)OC2=CC3=C(C=C2)C(=O)C(=CO3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C26H21ClO5/c1-17-5-2-3-6-23(17)30-14-4-7-25(28)32-20-12-13-21-24(15-20)31-16-22(26(21)29)18-8-10-19(27)11-9-18/h2-3,5-6,8-13,15-16H,4,7,14H2,1H3