N-(1,3-benzodioxol-5-ylmethyl)-5-methyl-heptan-3-amine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-methyl-heptan-3-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-5-methyl-heptan-3-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-methyl-3-heptanamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-methylheptan-3-amine Traditional Name: (1-ethyl-3-methyl-pentyl)-piperonyl-amine Formula: C16H25NO2 MolecularWeight: 263.3752

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC(CC)NCC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CCC(C)CC(CC)NCC1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C16H25NO2/c1-4-12(3)8-14(5-2)17-10-13-6-7-15-16(9-13)19-11-18-15/h6-7,9,12,14,17H,4-5,8,10-11H2,1-3H3