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

Systemtic Name: 4-[(R)-(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)-quinolin-6-yl-methyl]morpholin-4-ium Openeye Name: 4-[(R)-(1-cyclohexyltetrazol-5-yl)-(6-quinolyl)methyl]morpholin-4-ium CAS Name: 4-[(R)-(1-cyclohexyl-5-tetrazolyl)-(6-quinolinyl)methyl]morpholin-4-ium IUPAC Name: 4-[(R)-(1-cyclohexyltetrazol-5-yl)-quinolin-6-ylmethyl]morpholin-4-ium Traditional Name: 4-[(R)-(1-cyclohexyltetrazol-5-yl)-(6-quinolyl)methyl]morpholin-4-ium Formula: C21H27N6O+ MolecularWeight: 379.47868

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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+]5CCOCC5

Isomeric SMILES

C1CCC(CC1)N2C(=NN=N2)[C@@H](C3=CC4=C(C=C3)N=CC=C4)[NH+]5CCOCC5

InChI

InChI=1S/C21H26N6O/c1-2-6-18(7-3-1)27-21(23-24-25-27)20(26-11-13-28-14-12-26)17-8-9-19-16(15-17)5-4-10-22-19/h4-5,8-10,15,18,20H,1-3,6-7,11-14H2/p+1/t20-/m1/s1