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

Systemtic Name: 3-[(R)-(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-6-methyl-1H-quinolin-2-one Openeye Name: 3-[(R)-(1-cyclopentyltetrazol-5-yl)-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-6-methyl-1H-quinolin-2-one CAS Name: 3-[(R)-(1-cyclopentyl-5-tetrazolyl)-[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]methyl]-6-methyl-1H-quinolin-2-one IUPAC Name: 3-[(R)-(1-cyclopentyltetrazol-5-yl)-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-6-methyl-1H-quinolin-2-one Traditional Name: 3-[(R)-(1-cyclopentyltetrazol-5-yl)-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-6-methyl-carbostyril Formula: C28H34N7O2+ MolecularWeight: 500.61526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=O)C(=C2)C(C3=NN=NN3C4CCCC4)[NH+]5CCN(CC5)C6=CC=CC=C6OC

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=O)C(=C2)[C@H](C3=NN=NN3C4CCCC4)[NH+]5CCN(CC5)C6=CC=CC=C6OC

InChI

InChI=1S/C28H33N7O2/c1-19-11-12-23-20(17-19)18-22(28(36)29-23)26(27-30-31-32-35(27)21-7-3-4-8-21)34-15-13-33(14-16-34)24-9-5-6-10-25(24)37-2/h5-6,9-12,17-18,21,26H,3-4,7-8,13-16H2,1-2H3,(H,29,36)/p+1/t26-/m1/s1