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

Systemtic Name: 7-[(4-bromophenyl)methoxy]-3-hexyl-4-methyl-chromen-2-one Openeye Name: 7-[(4-bromophenyl)methoxy]-3-hexyl-4-methyl-chromen-2-one CAS Name: 7-[(4-bromophenyl)methoxy]-3-hexyl-4-methyl-1-benzopyran-2-one IUPAC Name: 7-[(4-bromophenyl)methoxy]-3-hexyl-4-methylchromen-2-one Traditional Name: 7-(4-bromobenzyl)oxy-3-hexyl-4-methyl-coumarin Formula: C23H25BrO3 MolecularWeight: 429.3468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C2=C(C=C(C=C2)OCC3=CC=C(C=C3)Br)OC1=O)C

Isomeric SMILES

CCCCCCC1=C(C2=C(C=C(C=C2)OCC3=CC=C(C=C3)Br)OC1=O)C

InChI

InChI=1S/C23H25BrO3/c1-3-4-5-6-7-21-16(2)20-13-12-19(14-22(20)27-23(21)25)26-15-17-8-10-18(24)11-9-17/h8-14H,3-7,15H2,1-2H3