cyclopentyl-[(6,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-[(1S)-1-[1-(2-ethoxy-2-oxidanylidene-ethyl)-1,2,3,4-tetrazol-5-yl]propyl]azanium

Systemtic Name: cyclopentyl-[(6,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-[(1S)-1-[1-(2-ethoxy-2-oxidanylidene-ethyl)-1,2,3,4-tetrazol-5-yl]propyl]azanium Openeye Name: cyclopentyl-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-[(1S)-1-[1-(2-ethoxy-2-oxo-ethyl)tetrazol-5-yl]propyl]ammonium CAS Name: cyclopentyl-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-[(1S)-1-[1-(2-ethoxy-2-oxoethyl)-5-tetrazolyl]propyl]ammonium IUPAC Name: cyclopentyl-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-[(1S)-1-[1-(2-ethoxy-2-oxoethyl)tetrazol-5-yl]propyl]azanium Traditional Name: cyclopentyl-[(1S)-1-[1-(2-ethoxy-2-keto-ethyl)tetrazol-5-yl]propyl]-[(2-keto-6,7-dimethyl-1H-quinolin-3-yl)methyl]ammonium Formula: C25H35N6O3+ MolecularWeight: 467.5838

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NN=NN1CC(=O)OCC)[NH+](CC2=CC3=CC(=C(C=C3NC2=O)C)C)C4CCCC4

Isomeric SMILES

CC[C@@H](C1=NN=NN1CC(=O)OCC)[NH+](CC2=CC3=CC(=C(C=C3NC2=O)C)C)C4CCCC4

InChI

InChI=1S/C25H34N6O3/c1-5-22(24-27-28-29-31(24)15-23(32)34-6-2)30(20-9-7-8-10-20)14-19-13-18-11-16(3)17(4)12-21(18)26-25(19)33/h11-13,20,22H,5-10,14-15H2,1-4H3,(H,26,33)/p+1/t22-/m0/s1