N-[4-(1,3-benzodioxol-5-yl)butan-2-yl]heptan-2-amine

Systemtic Name: N-[4-(1,3-benzodioxol-5-yl)butan-2-yl]heptan-2-amine Openeye Name: N-[3-(1,3-benzodioxol-5-yl)-1-methyl-propyl]heptan-2-amine CAS Name: N-[4-(1,3-benzodioxol-5-yl)butan-2-yl]-2-heptanamine IUPAC Name: N-[4-(1,3-benzodioxol-5-yl)butan-2-yl]heptan-2-amine Traditional Name: [3-(1,3-benzodioxol-5-yl)-1-methyl-propyl]-(1-methylhexyl)amine Formula: C18H29NO2 MolecularWeight: 291.42836

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(C)CCC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CCCCCC(C)NC(C)CCC1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C18H29NO2/c1-4-5-6-7-14(2)19-15(3)8-9-16-10-11-17-18(12-16)21-13-20-17/h10-12,14-15,19H,4-9,13H2,1-3H3