4,7-dimethyl-5-oxidanyl-3-(phenylmethyl)chromen-2-one

Systemtic Name: 4,7-dimethyl-5-oxidanyl-3-(phenylmethyl)chromen-2-one Openeye Name: 3-benzyl-5-hydroxy-4,7-dimethyl-chromen-2-one CAS Name: 5-hydroxy-4,7-dimethyl-3-(phenylmethyl)-1-benzopyran-2-one IUPAC Name: 3-benzyl-5-hydroxy-4,7-dimethylchromen-2-one Traditional Name: 3-benzyl-5-hydroxy-4,7-dimethyl-coumarin Formula: C18H16O3 MolecularWeight: 280.31784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C(C(=O)O2)CC3=CC=CC=C3)C)C(=C1)O

Isomeric SMILES

CC1=CC2=C(C(=C(C(=O)O2)CC3=CC=CC=C3)C)C(=C1)O

InChI

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