(1-tert-butyl-1,2,3,4-tetrazol-5-yl)methyl-cyclopentyl-[(8-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]azanium

Systemtic Name: (1-tert-butyl-1,2,3,4-tetrazol-5-yl)methyl-cyclopentyl-[(8-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]azanium Openeye Name: (1-tert-butyltetrazol-5-yl)methyl-cyclopentyl-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]ammonium CAS Name: (1-tert-butyl-5-tetrazolyl)methyl-cyclopentyl-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]ammonium IUPAC Name: (1-tert-butyltetrazol-5-yl)methyl-cyclopentyl-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]azanium Traditional Name: (1-tert-butyltetrazol-5-yl)methyl-cyclopentyl-[(2-keto-8-methyl-1H-quinolin-3-yl)methyl]ammonium Formula: C22H31N6O+ MolecularWeight: 395.52114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC(=O)C(=C2)C[NH+](CC3=NN=NN3C(C)(C)C)C4CCCC4

Isomeric SMILES

CC1=CC=CC2=C1NC(=O)C(=C2)C[NH+](CC3=NN=NN3C(C)(C)C)C4CCCC4

InChI

InChI=1S/C22H30N6O/c1-15-8-7-9-16-12-17(21(29)23-20(15)16)13-27(18-10-5-6-11-18)14-19-24-25-26-28(19)22(2,3)4/h7-9,12,18H,5-6,10-11,13-14H2,1-4H3,(H,23,29)/p+1