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

Systemtic Name: 3-[(R)-azepan-1-ium-1-yl-(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)methyl]-5,8-dimethyl-1H-quinolin-2-one Openeye Name: 3-[(R)-azepan-1-ium-1-yl-(1-cyclopentyltetrazol-5-yl)methyl]-5,8-dimethyl-1H-quinolin-2-one CAS Name: 3-[(R)-1-azepan-1-iumyl-(1-cyclopentyl-5-tetrazolyl)methyl]-5,8-dimethyl-1H-quinolin-2-one IUPAC Name: 3-[(R)-azepan-1-ium-1-yl-(1-cyclopentyltetrazol-5-yl)methyl]-5,8-dimethyl-1H-quinolin-2-one Traditional Name: 3-[(R)-azepan-1-ium-1-yl-(1-cyclopentyltetrazol-5-yl)methyl]-5,8-dimethyl-carbostyril Formula: C24H33N6O+ MolecularWeight: 421.55842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C(=O)NC2=C(C=C1)C)C(C3=NN=NN3C4CCCC4)[NH+]5CCCCCC5

Isomeric SMILES

CC1=C2C=C(C(=O)NC2=C(C=C1)C)[C@H](C3=NN=NN3C4CCCC4)[NH+]5CCCCCC5

InChI

InChI=1S/C24H32N6O/c1-16-11-12-17(2)21-19(16)15-20(24(31)25-21)22(29-13-7-3-4-8-14-29)23-26-27-28-30(23)18-9-5-6-10-18/h11-12,15,18,22H,3-10,13-14H2,1-2H3,(H,25,31)/p+1/t22-/m1/s1