(2,2-dimethyl-5,6,7,7a-tetrahydro-4H-1,3-benzodioxol-3a-yl)-phenyl-methanone

Systemtic Name: (2,2-dimethyl-5,6,7,7a-tetrahydro-4H-1,3-benzodioxol-3a-yl)-phenyl-methanone Openeye Name: (2,2-dimethyl-5,6,7,7a-tetrahydro-4H-1,3-benzodioxol-3a-yl)-phenyl-methanone CAS Name: (2,2-dimethyl-5,6,7,7a-tetrahydro-4H-1,3-benzodioxol-3a-yl)-phenylmethanone IUPAC Name: (2,2-dimethyl-5,6,7,7a-tetrahydro-4H-1,3-benzodioxol-3a-yl)-phenylmethanone Traditional Name: (2,2-dimethyl-5,6,7,7a-tetrahydro-4H-1,3-benzodioxol-3a-yl)-phenyl-methanone Formula: C16H20O3 MolecularWeight: 260.3282

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC2CCCCC2(O1)C(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1(OC2CCCCC2(O1)C(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C16H20O3/c1-15(2)18-13-10-6-7-11-16(13,19-15)14(17)12-8-4-3-5-9-12/h3-5,8-9,13H,6-7,10-11H2,1-2H3