N4-[(3S)-1-[(3-methoxyphenyl)methyl]piperidin-1-ium-3-yl]-N1,N1-dimethyl-piperidine-1,4-dicarboxamide

Systemtic Name: N4-[(3S)-1-[(3-methoxyphenyl)methyl]piperidin-1-ium-3-yl]-N1,N1-dimethyl-piperidine-1,4-dicarboxamide Openeye Name: N4-[(3S)-1-[(3-methoxyphenyl)methyl]piperidin-1-ium-3-yl]-N1,N1-dimethyl-piperidine-1,4-dicarboxamide CAS Name: N4-[(3S)-1-[(3-methoxyphenyl)methyl]-3-piperidin-1-iumyl]-N1,N1-dimethylpiperidine-1,4-dicarboxamide IUPAC Name: 4-N-[(3S)-1-[(3-methoxyphenyl)methyl]piperidin-1-ium-3-yl]-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide Traditional Name: N'-[(3S)-1-m-anisylpiperidin-1-ium-3-yl]-N,N-dimethyl-piperidine-1,4-dicarboxamide Formula: C22H35N4O3+ MolecularWeight: 403.5383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)N1CCC(CC1)C(=O)NC2CCC[NH+](C2)CC3=CC(=CC=C3)OC

Isomeric SMILES

CN(C)C(=O)N1CCC(CC1)C(=O)N[C@H]2CCC[NH+](C2)CC3=CC(=CC=C3)OC

InChI

InChI=1S/C22H34N4O3/c1-24(2)22(28)26-12-9-18(10-13-26)21(27)23-19-7-5-11-25(16-19)15-17-6-4-8-20(14-17)29-3/h4,6,8,14,18-19H,5,7,9-13,15-16H2,1-3H3,(H,23,27)/p+1/t19-/m0/s1