4-methyl-N-[(3-methylthiophen-2-yl)methyl]-2-nitro-aniline

Systemtic Name: 4-methyl-N-[(3-methylthiophen-2-yl)methyl]-2-nitro-aniline Openeye Name: 4-methyl-N-[(3-methyl-2-thienyl)methyl]-2-nitro-aniline CAS Name: 4-methyl-N-[(3-methyl-2-thiophenyl)methyl]-2-nitroaniline IUPAC Name: 4-methyl-N-[(3-methylthiophen-2-yl)methyl]-2-nitroaniline Traditional Name: (4-methyl-2-nitro-phenyl)-[(3-methyl-2-thienyl)methyl]amine Formula: C13H14N2O2S MolecularWeight: 262.32746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NCC2=C(C=CS2)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NCC2=C(C=CS2)C)[N+](=O)[O-]

InChI

InChI=1S/C13H14N2O2S/c1-9-3-4-11(12(7-9)15(16)17)14-8-13-10(2)5-6-18-13/h3-7,14H,8H2,1-2H3