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

Systemtic Name: 3-[(R)-(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)-piperidin-1-ium-1-yl-methyl]-6-ethyl-1H-quinolin-2-one Openeye Name: 3-[(R)-(1-cyclohexyltetrazol-5-yl)-piperidin-1-ium-1-yl-methyl]-6-ethyl-1H-quinolin-2-one CAS Name: 3-[(R)-(1-cyclohexyl-5-tetrazolyl)-(1-piperidin-1-iumyl)methyl]-6-ethyl-1H-quinolin-2-one IUPAC Name: 3-[(R)-(1-cyclohexyltetrazol-5-yl)-piperidin-1-ium-1-ylmethyl]-6-ethyl-1H-quinolin-2-one Traditional Name: 3-[(R)-(1-cyclohexyltetrazol-5-yl)-piperidin-1-ium-1-yl-methyl]-6-ethyl-carbostyril Formula: C24H33N6O+ MolecularWeight: 421.55842

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)NC(=O)C(=C2)C(C3=NN=NN3C4CCCCC4)[NH+]5CCCCC5

Isomeric SMILES

CCC1=CC2=C(C=C1)NC(=O)C(=C2)[C@H](C3=NN=NN3C4CCCCC4)[NH+]5CCCCC5

InChI

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