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

Systemtic Name: 3-[(R)-azepan-1-ium-1-yl-(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)methyl]-7-methoxy-1H-quinolin-2-one Openeye Name: 3-[(R)-azepan-1-ium-1-yl-(1-cyclopentyltetrazol-5-yl)methyl]-7-methoxy-1H-quinolin-2-one CAS Name: 3-[(R)-1-azepan-1-iumyl-(1-cyclopentyl-5-tetrazolyl)methyl]-7-methoxy-1H-quinolin-2-one IUPAC Name: 3-[(R)-azepan-1-ium-1-yl-(1-cyclopentyltetrazol-5-yl)methyl]-7-methoxy-1H-quinolin-2-one Traditional Name: 3-[(R)-azepan-1-ium-1-yl-(1-cyclopentyltetrazol-5-yl)methyl]-7-methoxy-carbostyril Formula: C23H31N6O2+ MolecularWeight: 423.53124

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=C(C(=O)N2)C(C3=NN=NN3C4CCCC4)[NH+]5CCCCCC5

Isomeric SMILES

COC1=CC2=C(C=C1)C=C(C(=O)N2)[C@H](C3=NN=NN3C4CCCC4)[NH+]5CCCCCC5

InChI

InChI=1S/C23H30N6O2/c1-31-18-11-10-16-14-19(23(30)24-20(16)15-18)21(28-12-6-2-3-7-13-28)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