2-hydroxyethyl-[(3-nitrophenyl)methyl]-(phenylmethyl)azanium

Systemtic Name: 2-hydroxyethyl-[(3-nitrophenyl)methyl]-(phenylmethyl)azanium Openeye Name: benzyl-(2-hydroxyethyl)-[(3-nitrophenyl)methyl]ammonium CAS Name: 2-hydroxyethyl-[(3-nitrophenyl)methyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-(2-hydroxyethyl)-[(3-nitrophenyl)methyl]azanium Traditional Name: benzyl-(2-hydroxyethyl)-(3-nitrobenzyl)ammonium Formula: C16H19N2O3+ MolecularWeight: 287.33366

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[NH+](CCO)CC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C[NH+](CCO)CC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H18N2O3/c19-10-9-17(12-14-5-2-1-3-6-14)13-15-7-4-8-16(11-15)18(20)21/h1-8,11,19H,9-10,12-13H2/p+1