N-[(1R)-1-[1-[[(1S)-cyclohex-3-en-1-yl]methyl]piperidin-1-ium-4-yl]-2-phenyl-ethyl]-N-methyl-thiophene-3-carboxamide

Systemtic Name: N-[(1R)-1-[1-[[(1S)-cyclohex-3-en-1-yl]methyl]piperidin-1-ium-4-yl]-2-phenyl-ethyl]-N-methyl-thiophene-3-carboxamide Openeye Name: N-[(1R)-1-[1-[[(1S)-cyclohex-3-en-1-yl]methyl]piperidin-1-ium-4-yl]-2-phenyl-ethyl]-N-methyl-thiophene-3-carboxamide CAS Name: N-[(1R)-1-[1-[[(1S)-1-cyclohex-3-enyl]methyl]-4-piperidin-1-iumyl]-2-phenylethyl]-N-methyl-3-thiophenecarboxamide IUPAC Name: N-[(1R)-1-[1-[[(1S)-cyclohex-3-en-1-yl]methyl]piperidin-1-ium-4-yl]-2-phenylethyl]-N-methylthiophene-3-carboxamide Traditional Name: N-[(1R)-1-[1-[[(1S)-cyclohex-3-en-1-yl]methyl]piperidin-1-ium-4-yl]-2-phenyl-ethyl]-N-methyl-thiophene-3-carboxamide Formula: C26H35N2OS+ MolecularWeight: 423.6339

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(CC1=CC=CC=C1)C2CC[NH+](CC2)CC3CCC=CC3)C(=O)C4=CSC=C4

Isomeric SMILES

CN([C@H](CC1=CC=CC=C1)C2CC[NH+](CC2)C[C@H]3CCC=CC3)C(=O)C4=CSC=C4

InChI

InChI=1S/C26H34N2OS/c1-27(26(29)24-14-17-30-20-24)25(18-21-8-4-2-5-9-21)23-12-15-28(16-13-23)19-22-10-6-3-7-11-22/h2-6,8-9,14,17,20,22-23,25H,7,10-13,15-16,18-19H2,1H3/p+1/t22-,25-/m1/s1