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

Systemtic Name: (6,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl-[(1S)-1-[1-(2-methoxyethyl)-1,2,3,4-tetrazol-5-yl]propyl]-[[(2S)-oxolan-2-yl]methyl]azanium Openeye Name: (6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl-[(1S)-1-[1-(2-methoxyethyl)tetrazol-5-yl]propyl]-[[(2S)-tetrahydrofuran-2-yl]methyl]ammonium CAS Name: (6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl-[(1S)-1-[1-(2-methoxyethyl)-5-tetrazolyl]propyl]-[[(2S)-2-oxolanyl]methyl]ammonium IUPAC Name: (6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl-[(1S)-1-[1-(2-methoxyethyl)tetrazol-5-yl]propyl]-[[(2S)-oxolan-2-yl]methyl]azanium Traditional Name: (2-keto-6,7-dimethyl-1H-quinolin-3-yl)methyl-[(1S)-1-[1-(2-methoxyethyl)tetrazol-5-yl]propyl]-[[(2S)-tetrahydrofuran-2-yl]methyl]ammonium Formula: C24H35N6O3+ MolecularWeight: 455.5731

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NN=NN1CCOC)[NH+](CC2CCCO2)CC3=CC4=CC(=C(C=C4NC3=O)C)C

Isomeric SMILES

CC[C@@H](C1=NN=NN1CCOC)[NH+](C[C@@H]2CCCO2)CC3=CC4=CC(=C(C=C4NC3=O)C)C

InChI

InChI=1S/C24H34N6O3/c1-5-22(23-26-27-28-30(23)8-10-32-4)29(15-20-7-6-9-33-20)14-19-13-18-11-16(2)17(3)12-21(18)25-24(19)31/h11-13,20,22H,5-10,14-15H2,1-4H3,(H,25,31)/p+1/t20-,22-/m0/s1