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

Systemtic Name: [(1S)-1-(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)propyl]-[(6,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-[(2-methoxyphenyl)methyl]azanium Openeye Name: [(1S)-1-(1-cyclopentyltetrazol-5-yl)propyl]-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-[(2-methoxyphenyl)methyl]ammonium CAS Name: [(1S)-1-(1-cyclopentyl-5-tetrazolyl)propyl]-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-[(2-methoxyphenyl)methyl]ammonium IUPAC Name: [(1S)-1-(1-cyclopentyltetrazol-5-yl)propyl]-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-[(2-methoxyphenyl)methyl]azanium Traditional Name: [(1S)-1-(1-cyclopentyltetrazol-5-yl)propyl]-[(2-keto-6,7-dimethyl-1H-quinolin-3-yl)methyl]-o-anisyl-ammonium Formula: C29H37N6O2+ MolecularWeight: 501.64308

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NN=NN1C2CCCC2)[NH+](CC3=CC=CC=C3OC)CC4=CC5=CC(=C(C=C5NC4=O)C)C

Isomeric SMILES

CC[C@@H](C1=NN=NN1C2CCCC2)[NH+](CC3=CC=CC=C3OC)CC4=CC5=CC(=C(C=C5NC4=O)C)C

InChI

InChI=1S/C29H36N6O2/c1-5-26(28-31-32-33-35(28)24-11-7-8-12-24)34(17-21-10-6-9-13-27(21)37-4)18-23-16-22-14-19(2)20(3)15-25(22)30-29(23)36/h6,9-10,13-16,24,26H,5,7-8,11-12,17-18H2,1-4H3,(H,30,36)/p+1/t26-/m0/s1