3-[(S)-(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)-piperidin-1-ium-1-yl-methyl]-6,8-dimethyl-1H-quinolin-2-one

Systemtic Name: 3-[(S)-(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)-piperidin-1-ium-1-yl-methyl]-6,8-dimethyl-1H-quinolin-2-one Openeye Name: 3-[(S)-(1-cyclopentyltetrazol-5-yl)-piperidin-1-ium-1-yl-methyl]-6,8-dimethyl-1H-quinolin-2-one CAS Name: 3-[(S)-(1-cyclopentyl-5-tetrazolyl)-(1-piperidin-1-iumyl)methyl]-6,8-dimethyl-1H-quinolin-2-one IUPAC Name: 3-[(S)-(1-cyclopentyltetrazol-5-yl)-piperidin-1-ium-1-ylmethyl]-6,8-dimethyl-1H-quinolin-2-one Traditional Name: 3-[(S)-(1-cyclopentyltetrazol-5-yl)-piperidin-1-ium-1-yl-methyl]-6,8-dimethyl-carbostyril Formula: C23H31N6O+ MolecularWeight: 407.53184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C=C(C(=O)N2)C(C3=NN=NN3C4CCCC4)[NH+]5CCCCC5)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C=C(C(=O)N2)[C@@H](C3=NN=NN3C4CCCC4)[NH+]5CCCCC5)C

InChI

InChI=1S/C23H30N6O/c1-15-12-16(2)20-17(13-15)14-19(23(30)24-20)21(28-10-6-3-7-11-28)22-25-26-27-29(22)18-8-4-5-9-18/h12-14,18,21H,3-11H2,1-2H3,(H,24,30)/p+1/t21-/m0/s1