N-[(4-methoxyphenyl)methyl]-4-methyl-N-[[8-methyl-2-[(3S)-3-oxidanylpiperidin-1-yl]quinolin-1-ium-3-yl]methyl]benzamide

Systemtic Name: N-[(4-methoxyphenyl)methyl]-4-methyl-N-[[8-methyl-2-[(3S)-3-oxidanylpiperidin-1-yl]quinolin-1-ium-3-yl]methyl]benzamide Openeye Name: N-[[2-[(3S)-3-hydroxy-1-piperidyl]-8-methyl-quinolin-1-ium-3-yl]methyl]-N-[(4-methoxyphenyl)methyl]-4-methyl-benzamide CAS Name: N-[[2-[(3S)-3-hydroxy-1-piperidinyl]-8-methyl-3-quinolin-1-iumyl]methyl]-N-[(4-methoxyphenyl)methyl]-4-methylbenzamide IUPAC Name: N-[[2-[(3S)-3-hydroxypiperidin-1-yl]-8-methylquinolin-1-ium-3-yl]methyl]-N-[(4-methoxyphenyl)methyl]-4-methylbenzamide Traditional Name: N-[[2-[(3S)-3-hydroxypiperidino]-8-methyl-quinolin-1-ium-3-yl]methyl]-4-methyl-N-p-anisyl-benzamide Formula: C32H36N3O3+ MolecularWeight: 510.64654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N(CC2=CC=C(C=C2)OC)CC3=C([NH+]=C4C(=CC=CC4=C3)C)N5CCCC(C5)O

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N(CC2=CC=C(C=C2)OC)CC3=C([NH+]=C4C(=CC=CC4=C3)C)N5CCC[C@@H](C5)O

InChI

InChI=1S/C32H35N3O3/c1-22-9-13-25(14-10-22)32(37)35(19-24-11-15-29(38-3)16-12-24)20-27-18-26-7-4-6-23(2)30(26)33-31(27)34-17-5-8-28(36)21-34/h4,6-7,9-16,18,28,36H,5,8,17,19-21H2,1-3H3/p+1/t28-/m0/s1