4-methyl-N-[(5-methylthiophen-2-yl)methyl]-3-nitro-aniline

Systemtic Name: 4-methyl-N-[(5-methylthiophen-2-yl)methyl]-3-nitro-aniline Openeye Name: 4-methyl-N-[(5-methyl-2-thienyl)methyl]-3-nitro-aniline CAS Name: 4-methyl-N-[(5-methyl-2-thiophenyl)methyl]-3-nitroaniline IUPAC Name: 4-methyl-N-[(5-methylthiophen-2-yl)methyl]-3-nitroaniline Traditional Name: (4-methyl-3-nitro-phenyl)-[(5-methyl-2-thienyl)methyl]amine Formula: C13H14N2O2S MolecularWeight: 262.32746

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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