1-[2-[(4-methoxyphenyl)methyl-[(2R)-1-thiophen-2-ylpropan-2-yl]amino]-2-oxidanylidene-ethyl]-N-methyl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[2-[(4-methoxyphenyl)methyl-[(2R)-1-thiophen-2-ylpropan-2-yl]amino]-2-oxidanylidene-ethyl]-N-methyl-piperidin-1-ium-4-carboxamide Openeye Name: 1-[2-[(4-methoxyphenyl)methyl-[(1R)-1-methyl-2-(2-thienyl)ethyl]amino]-2-oxo-ethyl]-N-methyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[2-[(4-methoxyphenyl)methyl-[(2R)-1-thiophen-2-ylpropan-2-yl]amino]-2-oxoethyl]-N-methyl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[2-[(4-methoxyphenyl)methyl-[(2R)-1-thiophen-2-ylpropan-2-yl]amino]-2-oxoethyl]-N-methylpiperidin-1-ium-4-carboxamide Traditional Name: 1-[2-keto-2-[[(1R)-1-methyl-2-(2-thienyl)ethyl]-p-anisyl-amino]ethyl]-N-methyl-piperidin-1-ium-4-carboxamide Formula: C24H34N3O3S+ MolecularWeight: 444.61006

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CS1)N(CC2=CC=C(C=C2)OC)C(=O)C[NH+]3CCC(CC3)C(=O)NC

Isomeric SMILES

C[C@H](CC1=CC=CS1)N(CC2=CC=C(C=C2)OC)C(=O)C[NH+]3CCC(CC3)C(=O)NC

InChI

InChI=1S/C24H33N3O3S/c1-18(15-22-5-4-14-31-22)27(16-19-6-8-21(30-3)9-7-19)23(28)17-26-12-10-20(11-13-26)24(29)25-2/h4-9,14,18,20H,10-13,15-17H2,1-3H3,(H,25,29)/p+1/t18-/m1/s1