N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-[(2S)-2-methylpiperidin-1-yl]sulfonyl-benzamide

Systemtic Name: N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-[(2S)-2-methylpiperidin-1-yl]sulfonyl-benzamide Openeye Name: N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-[[(2S)-2-methyl-1-piperidyl]sulfonyl]benzamide CAS Name: N-[(2R)-2-(2-methoxyphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-4-[[(2S)-2-methyl-1-piperidinyl]sulfonyl]benzamide IUPAC Name: N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-ylethyl]-4-[(2S)-2-methylpiperidin-1-yl]sulfonylbenzamide Traditional Name: N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-[(2S)-2-methylpiperidino]sulfonyl-benzamide Formula: C26H36N3O4S+ MolecularWeight: 486.64674

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NCC(C3=CC=CC=C3OC)[NH+]4CCCC4

Isomeric SMILES

C[C@H]1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NC[C@@H](C3=CC=CC=C3OC)[NH+]4CCCC4

InChI

InChI=1S/C26H35N3O4S/c1-20-9-5-6-18-29(20)34(31,32)22-14-12-21(13-15-22)26(30)27-19-24(28-16-7-8-17-28)23-10-3-4-11-25(23)33-2/h3-4,10-15,20,24H,5-9,16-19H2,1-2H3,(H,27,30)/p+1/t20-,24-/m0/s1