3-[(R)-(1-tert-butyl-1,2,3,4-tetrazol-5-yl)-(4-oxidanylpiperidin-1-ium-1-yl)methyl]-7,8-dimethyl-1H-quinolin-2-one

Systemtic Name: 3-[(R)-(1-tert-butyl-1,2,3,4-tetrazol-5-yl)-(4-oxidanylpiperidin-1-ium-1-yl)methyl]-7,8-dimethyl-1H-quinolin-2-one Openeye Name: 3-[(R)-(1-tert-butyltetrazol-5-yl)-(4-hydroxypiperidin-1-ium-1-yl)methyl]-7,8-dimethyl-1H-quinolin-2-one CAS Name: 3-[(R)-(1-tert-butyl-5-tetrazolyl)-(4-hydroxy-1-piperidin-1-iumyl)methyl]-7,8-dimethyl-1H-quinolin-2-one IUPAC Name: 3-[(R)-(1-tert-butyltetrazol-5-yl)-(4-hydroxypiperidin-1-ium-1-yl)methyl]-7,8-dimethyl-1H-quinolin-2-one Traditional Name: 3-[(R)-(1-tert-butyltetrazol-5-yl)-(4-hydroxypiperidin-1-ium-1-yl)methyl]-7,8-dimethyl-carbostyril Formula: C22H31N6O2+ MolecularWeight: 411.52054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C=C(C(=O)N2)C(C3=NN=NN3C(C)(C)C)[NH+]4CCC(CC4)O)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C=C(C(=O)N2)[C@H](C3=NN=NN3C(C)(C)C)[NH+]4CCC(CC4)O)C

InChI

InChI=1S/C22H30N6O2/c1-13-6-7-15-12-17(21(30)23-18(15)14(13)2)19(27-10-8-16(29)9-11-27)20-24-25-26-28(20)22(3,4)5/h6-7,12,16,19,29H,8-11H2,1-5H3,(H,23,30)/p+1/t19-/m1/s1