4,4-dimethoxy-2-(phenylmethyl)cyclohexa-2,5-dien-1-one

Systemtic Name: 4,4-dimethoxy-2-(phenylmethyl)cyclohexa-2,5-dien-1-one Openeye Name: 2-benzyl-4,4-dimethoxy-cyclohexa-2,5-dien-1-one CAS Name: 4,4-dimethoxy-2-(phenylmethyl)-1-cyclohexa-2,5-dienone IUPAC Name: 2-benzyl-4,4-dimethoxycyclohexa-2,5-dien-1-one Traditional Name: 2-benzyl-4,4-dimethoxy-cyclohexa-2,5-dien-1-one Formula: C15H16O3 MolecularWeight: 244.28574

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Descriptors Computed from Structure

Canonical SMILES:

COC1(C=CC(=O)C(=C1)CC2=CC=CC=C2)OC

Isomeric SMILES

COC1(C=CC(=O)C(=C1)CC2=CC=CC=C2)OC

InChI

InChI=1S/C15H16O3/c1-17-15(18-2)9-8-14(16)13(11-15)10-12-6-4-3-5-7-12/h3-9,11H,10H2,1-2H3