1-[(R)-(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)-quinolin-6-yl-methyl]piperidin-1-ium-4-ol

Systemtic Name: 1-[(R)-(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)-quinolin-6-yl-methyl]piperidin-1-ium-4-ol Openeye Name: 1-[(R)-(1-cyclohexyltetrazol-5-yl)-(6-quinolyl)methyl]piperidin-1-ium-4-ol CAS Name: 1-[(R)-(1-cyclohexyl-5-tetrazolyl)-(6-quinolinyl)methyl]-4-piperidin-1-iumol IUPAC Name: 1-[(R)-(1-cyclohexyltetrazol-5-yl)-quinolin-6-ylmethyl]piperidin-1-ium-4-ol Traditional Name: 1-[(R)-(1-cyclohexyltetrazol-5-yl)-(6-quinolyl)methyl]piperidin-1-ium-4-ol Formula: C22H29N6O+ MolecularWeight: 393.50526

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=NN=N2)C(C3=CC4=C(C=C3)N=CC=C4)[NH+]5CCC(CC5)O

Isomeric SMILES

C1CCC(CC1)N2C(=NN=N2)[C@@H](C3=CC4=C(C=C3)N=CC=C4)[NH+]5CCC(CC5)O

InChI

InChI=1S/C22H28N6O/c29-19-10-13-27(14-11-19)21(17-8-9-20-16(15-17)5-4-12-23-20)22-24-25-26-28(22)18-6-2-1-3-7-18/h4-5,8-9,12,15,18-19,21,29H,1-3,6-7,10-11,13-14H2/p+1/t21-/m1/s1