N-[(5-chloranylthiophen-2-yl)methyl]-N-methyl-2,4-dinitro-aniline

Systemtic Name: N-[(5-chloranylthiophen-2-yl)methyl]-N-methyl-2,4-dinitro-aniline Openeye Name: N-[(5-chloro-2-thienyl)methyl]-N-methyl-2,4-dinitro-aniline CAS Name: N-[(5-chloro-2-thiophenyl)methyl]-N-methyl-2,4-dinitroaniline IUPAC Name: N-[(5-chlorothiophen-2-yl)methyl]-N-methyl-2,4-dinitroaniline Traditional Name: (5-chloro-2-thienyl)methyl-(2,4-dinitrophenyl)-methyl-amine Formula: C12H10ClN3O4S MolecularWeight: 327.7435

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(S1)Cl)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC=C(S1)Cl)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H10ClN3O4S/c1-14(7-9-3-5-12(13)21-9)10-4-2-8(15(17)18)6-11(10)16(19)20/h2-6H,7H2,1H3