4-(hydroxymethyl)-7-methyl-2-(phenylmethyl)-3a,4,7,7a-tetrahydroindene-1,3-dione

Systemtic Name: 4-(hydroxymethyl)-7-methyl-2-(phenylmethyl)-3a,4,7,7a-tetrahydroindene-1,3-dione Openeye Name: 2-benzyl-4-(hydroxymethyl)-7-methyl-3a,4,7,7a-tetrahydroindene-1,3-dione CAS Name: 4-(hydroxymethyl)-7-methyl-2-(phenylmethyl)-3a,4,7,7a-tetrahydroindene-1,3-dione IUPAC Name: 2-benzyl-4-(hydroxymethyl)-7-methyl-3a,4,7,7a-tetrahydroindene-1,3-dione Traditional Name: 2-benzyl-4-methyl-7-methylol-3a,4,7,7a-tetrahydroindene-1,3-quinone Formula: C18H20O3 MolecularWeight: 284.3496

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=CC(C2C1C(=O)C(C2=O)CC3=CC=CC=C3)CO

Isomeric SMILES

CC1C=CC(C2C1C(=O)C(C2=O)CC3=CC=CC=C3)CO

InChI

InChI=1S/C18H20O3/c1-11-7-8-13(10-19)16-15(11)17(20)14(18(16)21)9-12-5-3-2-4-6-12/h2-8,11,13-16,19H,9-10H2,1H3