4-(1,3-benzodioxol-5-yl)-2-methyl-heptan-3-ol

Systemtic Name: 4-(1,3-benzodioxol-5-yl)-2-methyl-heptan-3-ol Openeye Name: 4-(1,3-benzodioxol-5-yl)-2-methyl-heptan-3-ol CAS Name: 4-(1,3-benzodioxol-5-yl)-2-methyl-3-heptanol IUPAC Name: 4-(1,3-benzodioxol-5-yl)-2-methylheptan-3-ol Traditional Name: 4-(1,3-benzodioxol-5-yl)-2-methyl-heptan-3-ol Formula: C15H22O3 MolecularWeight: 250.33338

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC2=C(C=C1)OCO2)C(C(C)C)O

Isomeric SMILES

CCCC(C1=CC2=C(C=C1)OCO2)C(C(C)C)O

InChI

InChI=1S/C15H22O3/c1-4-5-12(15(16)10(2)3)11-6-7-13-14(8-11)18-9-17-13/h6-8,10,12,15-16H,4-5,9H2,1-3H3