3,4-dimethoxy-N-[(5-nitrothiophen-2-yl)methyl]aniline

Systemtic Name: 3,4-dimethoxy-N-[(5-nitrothiophen-2-yl)methyl]aniline Openeye Name: 3,4-dimethoxy-N-[(5-nitro-2-thienyl)methyl]aniline CAS Name: 3,4-dimethoxy-N-[(5-nitro-2-thiophenyl)methyl]aniline IUPAC Name: 3,4-dimethoxy-N-[(5-nitrothiophen-2-yl)methyl]aniline Traditional Name: (3,4-dimethoxyphenyl)-[(5-nitro-2-thienyl)methyl]amine Formula: C13H14N2O4S MolecularWeight: 294.32626

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NCC2=CC=C(S2)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)NCC2=CC=C(S2)[N+](=O)[O-])OC

InChI

InChI=1S/C13H14N2O4S/c1-18-11-5-3-9(7-12(11)19-2)14-8-10-4-6-13(20-10)15(16)17/h3-7,14H,8H2,1-2H3