[3-azanyl-3-oxidanylidene-2-[(phenylmethyl)amino]propyl] hydrogen sulfate

Systemtic Name: [3-azanyl-3-oxidanylidene-2-[(phenylmethyl)amino]propyl] hydrogen sulfate Openeye Name: [3-amino-2-(benzylamino)-3-oxo-propyl] hydrogen sulfate CAS Name: sulfuric acid [3-amino-3-oxo-2-[(phenylmethyl)amino]propyl] ester IUPAC Name: [3-amino-2-(benzylamino)-3-oxopropyl] hydrogen sulfate Traditional Name: sulfuric acid [3-amino-2-(benzylamino)-3-keto-propyl] ester Formula: C10H14N2O5S MolecularWeight: 274.29356

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(COS(=O)(=O)O)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CNC(COS(=O)(=O)O)C(=O)N

InChI

InChI=1S/C10H14N2O5S/c11-10(13)9(7-17-18(14,15)16)12-6-8-4-2-1-3-5-8/h1-5,9,12H,6-7H2,(H2,11,13)(H,14,15,16)