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

Systemtic Name: N-methyl-N-[(3-methylthiophen-2-yl)methyl]-2,4-dinitro-aniline Openeye Name: N-methyl-N-[(3-methyl-2-thienyl)methyl]-2,4-dinitro-aniline CAS Name: N-methyl-N-[(3-methyl-2-thiophenyl)methyl]-2,4-dinitroaniline IUPAC Name: N-methyl-N-[(3-methylthiophen-2-yl)methyl]-2,4-dinitroaniline Traditional Name: (2,4-dinitrophenyl)-methyl-[(3-methyl-2-thienyl)methyl]amine Formula: C13H13N3O4S MolecularWeight: 307.32502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CN(C)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(SC=C1)CN(C)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H13N3O4S/c1-9-5-6-21-13(9)8-14(2)11-4-3-10(15(17)18)7-12(11)16(19)20/h3-7H,8H2,1-2H3