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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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