3-methyl-N-[(5-nitrothiophen-2-yl)methyl]aniline

Systemtic Name: 3-methyl-N-[(5-nitrothiophen-2-yl)methyl]aniline Openeye Name: 3-methyl-N-[(5-nitro-2-thienyl)methyl]aniline CAS Name: 3-methyl-N-[(5-nitro-2-thiophenyl)methyl]aniline IUPAC Name: 3-methyl-N-[(5-nitrothiophen-2-yl)methyl]aniline Traditional Name: m-tolyl-[(5-nitro-2-thienyl)methyl]amine Formula: C12H12N2O2S MolecularWeight: 248.30088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NCC2=CC=C(S2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)NCC2=CC=C(S2)[N+](=O)[O-]

InChI

InChI=1S/C12H12N2O2S/c1-9-3-2-4-10(7-9)13-8-11-5-6-12(17-11)14(15)16/h2-7,13H,8H2,1H3