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

Systemtic Name: 7-[(2-chlorophenyl)methoxy]-3-hexyl-4-methyl-chromen-2-one Openeye Name: 7-[(2-chlorophenyl)methoxy]-3-hexyl-4-methyl-chromen-2-one CAS Name: 7-[(2-chlorophenyl)methoxy]-3-hexyl-4-methyl-1-benzopyran-2-one IUPAC Name: 7-[(2-chlorophenyl)methoxy]-3-hexyl-4-methylchromen-2-one Traditional Name: 7-(2-chlorobenzyl)oxy-3-hexyl-4-methyl-coumarin Formula: C23H25ClO3 MolecularWeight: 384.8958

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C2=C(C=C(C=C2)OCC3=CC=CC=C3Cl)OC1=O)C

Isomeric SMILES

CCCCCCC1=C(C2=C(C=C(C=C2)OCC3=CC=CC=C3Cl)OC1=O)C

InChI

InChI=1S/C23H25ClO3/c1-3-4-5-6-10-20-16(2)19-13-12-18(14-22(19)27-23(20)25)26-15-17-9-7-8-11-21(17)24/h7-9,11-14H,3-6,10,15H2,1-2H3