N-(1,3-benzodioxol-4-ylmethyl)-4-methyl-2-nitro-aniline

Systemtic Name: N-(1,3-benzodioxol-4-ylmethyl)-4-methyl-2-nitro-aniline Openeye Name: N-(1,3-benzodioxol-4-ylmethyl)-4-methyl-2-nitro-aniline CAS Name: N-(1,3-benzodioxol-4-ylmethyl)-4-methyl-2-nitroaniline IUPAC Name: N-(1,3-benzodioxol-4-ylmethyl)-4-methyl-2-nitroaniline Traditional Name: 1,3-benzodioxol-4-ylmethyl-(4-methyl-2-nitro-phenyl)amine Formula: C15H14N2O4 MolecularWeight: 286.28266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NCC2=C3C(=CC=C2)OCO3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NCC2=C3C(=CC=C2)OCO3)[N+](=O)[O-]

InChI

InChI=1S/C15H14N2O4/c1-10-5-6-12(13(7-10)17(18)19)16-8-11-3-2-4-14-15(11)21-9-20-14/h2-7,16H,8-9H2,1H3