7-[(3-chlorophenyl)methoxy]-6-hexyl-4-phenyl-chromen-2-one

Systemtic Name: 7-[(3-chlorophenyl)methoxy]-6-hexyl-4-phenyl-chromen-2-one Openeye Name: 7-[(3-chlorophenyl)methoxy]-6-hexyl-4-phenyl-chromen-2-one CAS Name: 7-[(3-chlorophenyl)methoxy]-6-hexyl-4-phenyl-1-benzopyran-2-one IUPAC Name: 7-[(3-chlorophenyl)methoxy]-6-hexyl-4-phenylchromen-2-one Traditional Name: 7-(3-chlorobenzyl)oxy-6-hexyl-4-phenyl-coumarin Formula: C28H27ClO3 MolecularWeight: 446.96518

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=C2C(=C1)C(=CC(=O)O2)C3=CC=CC=C3)OCC4=CC(=CC=C4)Cl

Isomeric SMILES

CCCCCCC1=C(C=C2C(=C1)C(=CC(=O)O2)C3=CC=CC=C3)OCC4=CC(=CC=C4)Cl

InChI

InChI=1S/C28H27ClO3/c1-2-3-4-6-13-22-16-25-24(21-11-7-5-8-12-21)17-28(30)32-27(25)18-26(22)31-19-20-10-9-14-23(29)15-20/h5,7-12,14-18H,2-4,6,13,19H2,1H3