N-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2-methoxy-4-methylsulfanyl-benzamide

Systemtic Name: N-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2-methoxy-4-methylsulfanyl-benzamide Openeye Name: N-[(2R)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2-methoxy-4-methylsulfanyl-benzamide CAS Name: N-[(2R)-2-(2-furanyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-2-methoxy-4-(methylthio)benzamide IUPAC Name: N-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-ylethyl]-2-methoxy-4-methylsulfanylbenzamide Traditional Name: N-[(2R)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2-methoxy-4-(methylthio)benzamide Formula: C19H25N2O3S+ MolecularWeight: 361.4784

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)SC)C(=O)NCC(C2=CC=CO2)[NH+]3CCCC3

Isomeric SMILES

COC1=C(C=CC(=C1)SC)C(=O)NC[C@H](C2=CC=CO2)[NH+]3CCCC3

InChI

InChI=1S/C19H24N2O3S/c1-23-18-12-14(25-2)7-8-15(18)19(22)20-13-16(17-6-5-11-24-17)21-9-3-4-10-21/h5-8,11-12,16H,3-4,9-10,13H2,1-2H3,(H,20,22)/p+1/t16-/m1/s1