N-methyl-1-(4-methylphenyl)-1-(5-nitrofuran-2-yl)methanamine

Systemtic Name: N-methyl-1-(4-methylphenyl)-1-(5-nitrofuran-2-yl)methanamine Openeye Name: N-methyl-1-(5-nitro-2-furyl)-1-(p-tolyl)methanamine CAS Name: N-methyl-1-(4-methylphenyl)-1-(5-nitro-2-furanyl)methanamine IUPAC Name: N-methyl-1-(4-methylphenyl)-1-(5-nitrofuran-2-yl)methanamine Traditional Name: methyl-[(5-nitro-2-furyl)-(p-tolyl)methyl]amine Formula: C13H14N2O3 MolecularWeight: 246.26186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=C(O2)[N+](=O)[O-])NC

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=CC=C(O2)[N+](=O)[O-])NC

InChI

InChI=1S/C13H14N2O3/c1-9-3-5-10(6-4-9)13(14-2)11-7-8-12(18-11)15(16)17/h3-8,13-14H,1-2H3