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

Systemtic Name: [3-(4-chlorophenyl)-6-hexyl-4-oxidanylidene-chromen-7-yl] 4-methoxybenzoate Openeye Name: [3-(4-chlorophenyl)-6-hexyl-4-oxo-chromen-7-yl] 4-methoxybenzoate CAS Name: 4-methoxybenzoic 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-methoxybenzoate Traditional Name: 4-methoxybenzoic acid [3-(4-chlorophenyl)-6-hexyl-4-keto-chromen-7-yl] ester Formula: C29H27ClO5 MolecularWeight: 490.97468

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C29H27ClO5/c1-3-4-5-6-7-21-16-24-27(34-18-25(28(24)31)19-8-12-22(30)13-9-19)17-26(21)35-29(32)20-10-14-23(33-2)15-11-20/h8-18H,3-7H2,1-2H3