bis(2-hydroxyethyl)-[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: bis(2-hydroxyethyl)-[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: bis(2-hydroxyethyl)-[2-(4-nitroanilino)-2-oxo-ethyl]ammonium CAS Name: bis(2-hydroxyethyl)-[2-(4-nitroanilino)-2-oxoethyl]ammonium IUPAC Name: bis(2-hydroxyethyl)-[2-(4-nitroanilino)-2-oxoethyl]azanium Traditional Name: bis(2-hydroxyethyl)-[2-keto-2-(4-nitroanilino)ethyl]ammonium Formula: C12H18N3O5+ MolecularWeight: 284.28842

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)C[NH+](CCO)CCO)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NC(=O)C[NH+](CCO)CCO)[N+](=O)[O-]

InChI

InChI=1S/C12H17N3O5/c16-7-5-14(6-8-17)9-12(18)13-10-1-3-11(4-2-10)15(19)20/h1-4,16-17H,5-9H2,(H,13,18)/p+1