[(1S)-1-(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)propyl]-[(6,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-(pyridin-3-ylmethyl)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]-(pyridin-3-ylmethyl)azanium Openeye Name: [(1S)-1-(1-cyclopentyltetrazol-5-yl)propyl]-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-(3-pyridylmethyl)ammonium CAS Name: [(1S)-1-(1-cyclopentyl-5-tetrazolyl)propyl]-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-(3-pyridinylmethyl)ammonium IUPAC Name: [(1S)-1-(1-cyclopentyltetrazol-5-yl)propyl]-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-(pyridin-3-ylmethyl)azanium Traditional Name: [(1S)-1-(1-cyclopentyltetrazol-5-yl)propyl]-[(2-keto-6,7-dimethyl-1H-quinolin-3-yl)methyl]-(3-pyridylmethyl)ammonium Formula: C27H34N7O+ MolecularWeight: 472.60516

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H33N7O/c1-4-25(26-30-31-32-34(26)23-9-5-6-10-23)33(16-20-8-7-11-28-15-20)17-22-14-21-12-18(2)19(3)13-24(21)29-27(22)35/h7-8,11-15,23,25H,4-6,9-10,16-17H2,1-3H3,(H,29,35)/p+1/t25-/m0/s1