N-(1,3-benzodioxol-5-ylmethyl)-N-methyl-1-(4-nitrophenyl)methanamine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-methyl-1-(4-nitrophenyl)methanamine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-methyl-1-(4-nitrophenyl)methanamine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-methyl-1-(4-nitrophenyl)methanamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-methyl-1-(4-nitrophenyl)methanamine Traditional Name: methyl-(4-nitrobenzyl)-piperonyl-amine Formula: C16H16N2O4 MolecularWeight: 300.30924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)[N+](=O)[O-])CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CN(CC1=CC=C(C=C1)[N+](=O)[O-])CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H16N2O4/c1-17(9-12-2-5-14(6-3-12)18(19)20)10-13-4-7-15-16(8-13)22-11-21-15/h2-8H,9-11H2,1H3