2-methyl-5-methylsulfonyl-N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide

Systemtic Name: 2-methyl-5-methylsulfonyl-N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide Openeye Name: 2-methyl-5-methylsulfonyl-N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide CAS Name: 2-methyl-5-methylsulfonyl-N-[(2R)-2-phenyl-2-(1-pyrrolidin-1-iumyl)ethyl]benzamide IUPAC Name: 2-methyl-5-methylsulfonyl-N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-ylethyl]benzamide Traditional Name: 5-mesyl-2-methyl-N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide Formula: C21H27N2O3S+ MolecularWeight: 387.51568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)NCC(C2=CC=CC=C2)[NH+]3CCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)NC[C@@H](C2=CC=CC=C2)[NH+]3CCCC3

InChI

InChI=1S/C21H26N2O3S/c1-16-10-11-18(27(2,25)26)14-19(16)21(24)22-15-20(23-12-6-7-13-23)17-8-4-3-5-9-17/h3-5,8-11,14,20H,6-7,12-13,15H2,1-2H3,(H,22,24)/p+1/t20-/m0/s1