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

Systemtic Name: 3-[(R)-(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)-piperidin-1-ium-1-yl-methyl]-6-ethoxy-1H-quinolin-2-one Openeye Name: 3-[(R)-(1-cyclopentyltetrazol-5-yl)-piperidin-1-ium-1-yl-methyl]-6-ethoxy-1H-quinolin-2-one CAS Name: 3-[(R)-(1-cyclopentyl-5-tetrazolyl)-(1-piperidin-1-iumyl)methyl]-6-ethoxy-1H-quinolin-2-one IUPAC Name: 3-[(R)-(1-cyclopentyltetrazol-5-yl)-piperidin-1-ium-1-ylmethyl]-6-ethoxy-1H-quinolin-2-one Traditional Name: 3-[(R)-(1-cyclopentyltetrazol-5-yl)-piperidin-1-ium-1-yl-methyl]-6-ethoxy-carbostyril Formula: C23H31N6O2+ MolecularWeight: 423.53124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)NC(=O)C(=C2)C(C3=NN=NN3C4CCCC4)[NH+]5CCCCC5

Isomeric SMILES

CCOC1=CC2=C(C=C1)NC(=O)C(=C2)[C@H](C3=NN=NN3C4CCCC4)[NH+]5CCCCC5

InChI

InChI=1S/C23H30N6O2/c1-2-31-18-10-11-20-16(14-18)15-19(23(30)24-20)21(28-12-6-3-7-13-28)22-25-26-27-29(22)17-8-4-5-9-17/h10-11,14-15,17,21H,2-9,12-13H2,1H3,(H,24,30)/p+1/t21-/m1/s1