4,5-bis(1,3-benzodioxol-5-ylmethyl)-1-methyl-imidazol-2-amine

Systemtic Name: 4,5-bis(1,3-benzodioxol-5-ylmethyl)-1-methyl-imidazol-2-amine Openeye Name: 4,5-bis(1,3-benzodioxol-5-ylmethyl)-1-methyl-imidazol-2-amine CAS Name: 4,5-bis(1,3-benzodioxol-5-ylmethyl)-1-methyl-2-imidazolamine IUPAC Name: 4,5-bis(1,3-benzodioxol-5-ylmethyl)-1-methylimidazol-2-amine Traditional Name: (1-methyl-4,5-dipiperonyl-imidazol-2-yl)amine Formula: C20H19N3O4 MolecularWeight: 365.38256

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(N=C1N)CC2=CC3=C(C=C2)OCO3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CN1C(=C(N=C1N)CC2=CC3=C(C=C2)OCO3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C20H19N3O4/c1-23-15(7-13-3-5-17-19(9-13)27-11-25-17)14(22-20(23)21)6-12-2-4-16-18(8-12)26-10-24-16/h2-5,8-9H,6-7,10-11H2,1H3,(H2,21,22)