[3-(4-chlorophenyl)-6-hexyl-4-oxidanylidene-chromen-7-yl] 4-phenylbenzoate

Systemtic Name: [3-(4-chlorophenyl)-6-hexyl-4-oxidanylidene-chromen-7-yl] 4-phenylbenzoate Openeye Name: [3-(4-chlorophenyl)-6-hexyl-4-oxo-chromen-7-yl] 4-phenylbenzoate CAS Name: 4-phenylbenzoic acid [3-(4-chlorophenyl)-6-hexyl-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(4-chlorophenyl)-6-hexyl-4-oxochromen-7-yl] 4-phenylbenzoate Traditional Name: 4-phenylbenzoic acid [3-(4-chlorophenyl)-6-hexyl-4-keto-chromen-7-yl] ester Formula: C34H29ClO4 MolecularWeight: 537.04466

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC=C(C=C3)Cl)OC(=O)C4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

CCCCCCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC=C(C=C3)Cl)OC(=O)C4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C34H29ClO4/c1-2-3-4-6-11-27-20-29-32(38-22-30(33(29)36)25-16-18-28(35)19-17-25)21-31(27)39-34(37)26-14-12-24(13-15-26)23-9-7-5-8-10-23/h5,7-10,12-22H,2-4,6,11H2,1H3