[4-[1-(2,3-dimethoxyphenyl)carbonylpiperidin-4-yl]oxyphenyl]methyl-methyl-(quinolin-6-ylmethyl)azanium

Systemtic Name: [4-[1-(2,3-dimethoxyphenyl)carbonylpiperidin-4-yl]oxyphenyl]methyl-methyl-(quinolin-6-ylmethyl)azanium Openeye Name: [4-[[1-(2,3-dimethoxybenzoyl)-4-piperidyl]oxy]phenyl]methyl-methyl-(6-quinolylmethyl)ammonium CAS Name: [4-[[1-[(2,3-dimethoxyphenyl)-oxomethyl]-4-piperidinyl]oxy]phenyl]methyl-methyl-(6-quinolinylmethyl)ammonium IUPAC Name: [4-[1-(2,3-dimethoxybenzoyl)piperidin-4-yl]oxyphenyl]methyl-methyl-(quinolin-6-ylmethyl)azanium Traditional Name: methyl-[4-[(1-o-veratroyl-4-piperidyl)oxy]benzyl]-(6-quinolylmethyl)ammonium Formula: C32H36N3O4+ MolecularWeight: 526.64594

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)OC2CCN(CC2)C(=O)C3=C(C(=CC=C3)OC)OC)CC4=CC5=C(C=C4)N=CC=C5

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)OC2CCN(CC2)C(=O)C3=C(C(=CC=C3)OC)OC)CC4=CC5=C(C=C4)N=CC=C5

InChI

InChI=1S/C32H35N3O4/c1-34(22-24-11-14-29-25(20-24)6-5-17-33-29)21-23-9-12-26(13-10-23)39-27-15-18-35(19-16-27)32(36)28-7-4-8-30(37-2)31(28)38-3/h4-14,17,20,27H,15-16,18-19,21-22H2,1-3H3/p+1