3-[(R)-(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)-morpholin-4-ium-4-yl-methyl]-7-methyl-1H-quinolin-2-one

Systemtic Name: 3-[(R)-(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)-morpholin-4-ium-4-yl-methyl]-7-methyl-1H-quinolin-2-one Openeye Name: 3-[(R)-(1-cyclohexyltetrazol-5-yl)-morpholin-4-ium-4-yl-methyl]-7-methyl-1H-quinolin-2-one CAS Name: 3-[(R)-(1-cyclohexyl-5-tetrazolyl)-(4-morpholin-4-iumyl)methyl]-7-methyl-1H-quinolin-2-one IUPAC Name: 3-[(R)-(1-cyclohexyltetrazol-5-yl)-morpholin-4-ium-4-ylmethyl]-7-methyl-1H-quinolin-2-one Traditional Name: 3-[(R)-(1-cyclohexyltetrazol-5-yl)-morpholin-4-ium-4-yl-methyl]-7-methyl-carbostyril Formula: C22H29N6O2+ MolecularWeight: 409.50466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(C(=O)N2)C(C3=NN=NN3C4CCCCC4)[NH+]5CCOCC5

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(C(=O)N2)[C@H](C3=NN=NN3C4CCCCC4)[NH+]5CCOCC5

InChI

InChI=1S/C22H28N6O2/c1-15-7-8-16-14-18(22(29)23-19(16)13-15)20(27-9-11-30-12-10-27)21-24-25-26-28(21)17-5-3-2-4-6-17/h7-8,13-14,17,20H,2-6,9-12H2,1H3,(H,23,29)/p+1/t20-/m1/s1