bis(azanyl)methylidene-[3-(3,4-dihydro-2H-quinolin-1-yl)-2-oxidanyl-propyl]azanium; hydrogen sulfate

Systemtic Name: bis(azanyl)methylidene-[3-(3,4-dihydro-2H-quinolin-1-yl)-2-oxidanyl-propyl]azanium; hydrogen sulfate Openeye Name: diaminomethylene-[3-(3,4-dihydro-2H-quinolin-1-yl)-2-hydroxy-propyl]ammonium; hydrogen sulfate CAS Name: diaminomethylidene-[3-(3,4-dihydro-2H-quinolin-1-yl)-2-hydroxypropyl]ammonium; hydrogen sulfate IUPAC Name: diaminomethylidene-[3-(3,4-dihydro-2H-quinolin-1-yl)-2-hydroxypropyl]azanium; hydrogen sulfate Traditional Name: diaminomethylene-[3-(3,4-dihydro-2H-quinolin-1-yl)-2-hydroxy-propyl]ammonium bisulfate Formula: C13H22N4O5S MolecularWeight: 346.40258

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C1)CC(C[NH+]=C(N)N)O.OS(=O)(=O)[O-]

Isomeric SMILES

C1CC2=CC=CC=C2N(C1)CC(C[NH+]=C(N)N)O.OS(=O)(=O)[O-]

InChI

InChI=1S/C13H20N4O.H2O4S/c14-13(15)16-8-11(18)9-17-7-3-5-10-4-1-2-6-12(10)17;1-5(2,3)4/h1-2,4,6,11,18H,3,5,7-9H2,(H4,14,15,16);(H2,1,2,3,4)