8-methoxy-3-[(4-methylphenyl)methyl]chromen-2-one

Systemtic Name: 8-methoxy-3-[(4-methylphenyl)methyl]chromen-2-one Openeye Name: 8-methoxy-3-(p-tolylmethyl)chromen-2-one CAS Name: 8-methoxy-3-[(4-methylphenyl)methyl]-1-benzopyran-2-one IUPAC Name: 8-methoxy-3-[(4-methylphenyl)methyl]chromen-2-one Traditional Name: 8-methoxy-3-(4-methylbenzyl)coumarin Formula: C18H16O3 MolecularWeight: 280.31784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC2=CC3=C(C(=CC=C3)OC)OC2=O

Isomeric SMILES

CC1=CC=C(C=C1)CC2=CC3=C(C(=CC=C3)OC)OC2=O

InChI

InChI=1S/C18H16O3/c1-12-6-8-13(9-7-12)10-15-11-14-4-3-5-16(20-2)17(14)21-18(15)19/h3-9,11H,10H2,1-2H3