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

Systemtic Name: 4-ethyl-N-[(5-methylthiophen-2-yl)methyl]-3-nitro-aniline Openeye Name: 4-ethyl-N-[(5-methyl-2-thienyl)methyl]-3-nitro-aniline CAS Name: 4-ethyl-N-[(5-methyl-2-thiophenyl)methyl]-3-nitroaniline IUPAC Name: 4-ethyl-N-[(5-methylthiophen-2-yl)methyl]-3-nitroaniline Traditional Name: (4-ethyl-3-nitro-phenyl)-[(5-methyl-2-thienyl)methyl]amine Formula: C14H16N2O2S MolecularWeight: 276.35404

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)NCC2=CC=C(S2)C)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C=C(C=C1)NCC2=CC=C(S2)C)[N+](=O)[O-]

InChI

InChI=1S/C14H16N2O2S/c1-3-11-5-6-12(8-14(11)16(17)18)15-9-13-7-4-10(2)19-13/h4-8,15H,3,9H2,1-2H3