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

Systemtic Name: [(1S)-1-(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)propyl]-[(5,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-[(4-fluorophenyl)methyl]azanium Openeye Name: [(1S)-1-(1-cyclopentyltetrazol-5-yl)propyl]-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-[(4-fluorophenyl)methyl]ammonium CAS Name: [(1S)-1-(1-cyclopentyl-5-tetrazolyl)propyl]-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-[(4-fluorophenyl)methyl]ammonium IUPAC Name: [(1S)-1-(1-cyclopentyltetrazol-5-yl)propyl]-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-[(4-fluorophenyl)methyl]azanium Traditional Name: [(1S)-1-(1-cyclopentyltetrazol-5-yl)propyl]-(4-fluorobenzyl)-[(2-keto-5,7-dimethyl-1H-quinolin-3-yl)methyl]ammonium Formula: C28H34FN6O+ MolecularWeight: 489.607563

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NN=NN1C2CCCC2)[NH+](CC3=CC=C(C=C3)F)CC4=CC5=C(C=C(C=C5NC4=O)C)C

Isomeric SMILES

CC[C@@H](C1=NN=NN1C2CCCC2)[NH+](CC3=CC=C(C=C3)F)CC4=CC5=C(C=C(C=C5NC4=O)C)C

InChI

InChI=1S/C28H33FN6O/c1-4-26(27-31-32-33-35(27)23-7-5-6-8-23)34(16-20-9-11-22(29)12-10-20)17-21-15-24-19(3)13-18(2)14-25(24)30-28(21)36/h9-15,23,26H,4-8,16-17H2,1-3H3,(H,30,36)/p+1/t26-/m0/s1