8-[(E)-3-methyl-3-oxidanyl-but-1-enyl]-7-phenylmethoxy-chromen-2-one

Systemtic Name: 8-[(E)-3-methyl-3-oxidanyl-but-1-enyl]-7-phenylmethoxy-chromen-2-one Openeye Name: 7-benzyloxy-8-[(E)-3-hydroxy-3-methyl-but-1-enyl]chromen-2-one CAS Name: 8-[(E)-3-hydroxy-3-methylbut-1-enyl]-7-phenylmethoxy-1-benzopyran-2-one IUPAC Name: 8-[(E)-3-hydroxy-3-methylbut-1-enyl]-7-phenylmethoxychromen-2-one Traditional Name: 7-benzoxy-8-[(E)-3-hydroxy-3-methyl-but-1-enyl]coumarin Formula: C21H20O4 MolecularWeight: 336.3811

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C=CC1=C(C=CC2=C1OC(=O)C=C2)OCC3=CC=CC=C3)O

Isomeric SMILES

CC(C)(/C=C/C1=C(C=CC2=C1OC(=O)C=C2)OCC3=CC=CC=C3)O

InChI

InChI=1S/C21H20O4/c1-21(2,23)13-12-17-18(24-14-15-6-4-3-5-7-15)10-8-16-9-11-19(22)25-20(16)17/h3-13,23H,14H2,1-2H3/b13-12+