6-ethyl-3-[(R)-[1-(2-methylbutan-2-yl)-1,2,3,4-tetrazol-5-yl]-piperidin-1-ium-1-yl-methyl]-1H-quinolin-2-one

Systemtic Name: 6-ethyl-3-[(R)-[1-(2-methylbutan-2-yl)-1,2,3,4-tetrazol-5-yl]-piperidin-1-ium-1-yl-methyl]-1H-quinolin-2-one Openeye Name: 3-[(R)-[1-(1,1-dimethylpropyl)tetrazol-5-yl]-piperidin-1-ium-1-yl-methyl]-6-ethyl-1H-quinolin-2-one CAS Name: 6-ethyl-3-[(R)-[1-(2-methylbutan-2-yl)-5-tetrazolyl]-(1-piperidin-1-iumyl)methyl]-1H-quinolin-2-one IUPAC Name: 6-ethyl-3-[(R)-[1-(2-methylbutan-2-yl)tetrazol-5-yl]-piperidin-1-ium-1-ylmethyl]-1H-quinolin-2-one Traditional Name: 3-[(R)-(1-tert-amyltetrazol-5-yl)-piperidin-1-ium-1-yl-methyl]-6-ethyl-carbostyril Formula: C23H33N6O+ MolecularWeight: 409.54772

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)NC(=O)C(=C2)C(C3=NN=NN3C(C)(C)CC)[NH+]4CCCCC4

Isomeric SMILES

CCC1=CC2=C(C=C1)NC(=O)C(=C2)[C@H](C3=NN=NN3C(C)(C)CC)[NH+]4CCCCC4

InChI

InChI=1S/C23H32N6O/c1-5-16-10-11-19-17(14-16)15-18(22(30)24-19)20(28-12-8-7-9-13-28)21-25-26-27-29(21)23(3,4)6-2/h10-11,14-15,20H,5-9,12-13H2,1-4H3,(H,24,30)/p+1/t20-/m1/s1