2-azanyl-N-[1-(2-azanylethylamino)-3-(4-nitrophenyl)propan-2-yl]ethanamide

Systemtic Name: 2-azanyl-N-[1-(2-azanylethylamino)-3-(4-nitrophenyl)propan-2-yl]ethanamide Openeye Name: 2-amino-N-[1-[(2-aminoethylamino)methyl]-2-(4-nitrophenyl)ethyl]acetamide CAS Name: 2-amino-N-[1-(2-aminoethylamino)-3-(4-nitrophenyl)propan-2-yl]acetamide IUPAC Name: 2-amino-N-[1-(2-aminoethylamino)-3-(4-nitrophenyl)propan-2-yl]acetamide Traditional Name: 2-amino-N-[1-[(2-aminoethylamino)methyl]-2-(4-nitrophenyl)ethyl]acetamide Formula: C13H21N5O3 MolecularWeight: 295.33754

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(CNCCN)NC(=O)CN)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CC(CNCCN)NC(=O)CN)[N+](=O)[O-]

InChI

InChI=1S/C13H21N5O3/c14-5-6-16-9-11(17-13(19)8-15)7-10-1-3-12(4-2-10)18(20)21/h1-4,11,16H,5-9,14-15H2,(H,17,19)