4-methylsulfonyl-N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]benzamide

Systemtic Name: 4-methylsulfonyl-N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]benzamide Openeye Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-4-methylsulfonyl-benzamide CAS Name: 4-methylsulfonyl-N-[(3S)-1-(phenylmethyl)-3-pyrrolidin-1-iumyl]benzamide IUPAC Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-4-methylsulfonylbenzamide Traditional Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-4-mesyl-benzamide Formula: C19H23N2O3S+ MolecularWeight: 359.46252

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(=O)NC2CC[NH+](C2)CC3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(=O)N[C@H]2CC[NH+](C2)CC3=CC=CC=C3

InChI

InChI=1S/C19H22N2O3S/c1-25(23,24)18-9-7-16(8-10-18)19(22)20-17-11-12-21(14-17)13-15-5-3-2-4-6-15/h2-10,17H,11-14H2,1H3,(H,20,22)/p+1/t17-/m0/s1