N-[(4-nitrophenyl)methyl]prop-2-yn-1-amine

Systemtic Name: N-[(4-nitrophenyl)methyl]prop-2-yn-1-amine Openeye Name: N-[(4-nitrophenyl)methyl]prop-2-yn-1-amine CAS Name: N-[(4-nitrophenyl)methyl]-2-propyn-1-amine IUPAC Name: N-[(4-nitrophenyl)methyl]prop-2-yn-1-amine Traditional Name: (4-nitrobenzyl)-propargyl-amine Formula: C10H10N2O2 MolecularWeight: 190.1986

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNCC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

C#CCNCC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C10H10N2O2/c1-2-7-11-8-9-3-5-10(6-4-9)12(13)14/h1,3-6,11H,7-8H2