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

Systemtic Name: (1-tert-butyl-1,2,3,4-tetrazol-5-yl)methyl-[(6,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-[[(2S)-oxolan-2-yl]methyl]azanium Openeye Name: (1-tert-butyltetrazol-5-yl)methyl-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-[[(2S)-tetrahydrofuran-2-yl]methyl]ammonium CAS Name: (1-tert-butyl-5-tetrazolyl)methyl-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-[[(2S)-2-oxolanyl]methyl]ammonium IUPAC Name: (1-tert-butyltetrazol-5-yl)methyl-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-[[(2S)-oxolan-2-yl]methyl]azanium Traditional Name: (1-tert-butyltetrazol-5-yl)methyl-[(2-keto-6,7-dimethyl-1H-quinolin-3-yl)methyl]-[[(2S)-tetrahydrofuran-2-yl]methyl]ammonium Formula: C23H33N6O2+ MolecularWeight: 425.54712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C=C(C(=O)N2)C[NH+](CC3CCCO3)CC4=NN=NN4C(C)(C)C)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C=C(C(=O)N2)C[NH+](C[C@@H]3CCCO3)CC4=NN=NN4C(C)(C)C)C

InChI

InChI=1S/C23H32N6O2/c1-15-9-17-11-18(22(30)24-20(17)10-16(15)2)12-28(13-19-7-6-8-31-19)14-21-25-26-27-29(21)23(3,4)5/h9-11,19H,6-8,12-14H2,1-5H3,(H,24,30)/p+1/t19-/m0/s1