N-[(1S)-1-[1-[(3-ethoxy-4-methoxy-phenyl)methyl]piperidin-1-ium-4-yl]-2-phenyl-ethyl]-N-methyl-thiophene-2-carboxamide

Systemtic Name: N-[(1S)-1-[1-[(3-ethoxy-4-methoxy-phenyl)methyl]piperidin-1-ium-4-yl]-2-phenyl-ethyl]-N-methyl-thiophene-2-carboxamide Openeye Name: N-[(1S)-1-[1-[(3-ethoxy-4-methoxy-phenyl)methyl]piperidin-1-ium-4-yl]-2-phenyl-ethyl]-N-methyl-thiophene-2-carboxamide CAS Name: N-[(1S)-1-[1-[(3-ethoxy-4-methoxyphenyl)methyl]-4-piperidin-1-iumyl]-2-phenylethyl]-N-methyl-2-thiophenecarboxamide IUPAC Name: N-[(1S)-1-[1-[(3-ethoxy-4-methoxyphenyl)methyl]piperidin-1-ium-4-yl]-2-phenylethyl]-N-methylthiophene-2-carboxamide Traditional Name: N-[(1S)-1-[1-(3-ethoxy-4-methoxy-benzyl)piperidin-1-ium-4-yl]-2-phenyl-ethyl]-N-methyl-thiophene-2-carboxamide Formula: C29H37N2O3S+ MolecularWeight: 493.68068

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH+]2CCC(CC2)C(CC3=CC=CC=C3)N(C)C(=O)C4=CC=CS4)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH+]2CCC(CC2)[C@H](CC3=CC=CC=C3)N(C)C(=O)C4=CC=CS4)OC

InChI

InChI=1S/C29H36N2O3S/c1-4-34-27-20-23(12-13-26(27)33-3)21-31-16-14-24(15-17-31)25(19-22-9-6-5-7-10-22)30(2)29(32)28-11-8-18-35-28/h5-13,18,20,24-25H,4,14-17,19,21H2,1-3H3/p+1/t25-/m0/s1