N-[(2-methyl-3-nitro-phenyl)methyl]prop-2-yn-1-amine

Systemtic Name: N-[(2-methyl-3-nitro-phenyl)methyl]prop-2-yn-1-amine Openeye Name: N-[(2-methyl-3-nitro-phenyl)methyl]prop-2-yn-1-amine CAS Name: N-[(2-methyl-3-nitrophenyl)methyl]-2-propyn-1-amine IUPAC Name: N-[(2-methyl-3-nitrophenyl)methyl]prop-2-yn-1-amine Traditional Name: (2-methyl-3-nitro-benzyl)-propargyl-amine Formula: C11H12N2O2 MolecularWeight: 204.22518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])CNCC#C

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])CNCC#C

InChI

InChI=1S/C11H12N2O2/c1-3-7-12-8-10-5-4-6-11(9(10)2)13(14)15/h1,4-6,12H,7-8H2,2H3