N-methyl-N-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-1-(2,3,4-trimethoxyphenyl)methanamine

Systemtic Name: N-methyl-N-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-1-(2,3,4-trimethoxyphenyl)methanamine Openeye Name: N-methyl-N-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-1-(2,3,4-trimethoxyphenyl)methanamine CAS Name: N-methyl-N-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-1-(2,3,4-trimethoxyphenyl)methanamine IUPAC Name: N-methyl-N-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-1-(2,3,4-trimethoxyphenyl)methanamine Traditional Name: methyl-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-(2,3,4-trimethoxybenzyl)amine Formula: C20H24N2O7 MolecularWeight: 404.41376

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C(=C(C=C1)OC)OC)OC)CC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3

Isomeric SMILES

CN(CC1=C(C(=C(C=C1)OC)OC)OC)CC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3

InChI

InChI=1S/C20H24N2O7/c1-21(9-13-5-6-17(25-2)20(27-4)19(13)26-3)10-14-7-16(22(23)24)8-15-11-28-12-29-18(14)15/h5-8H,9-12H2,1-4H3