N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-methoxy-3-sulfamoyl-benzamide

Systemtic Name: N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-methoxy-3-sulfamoyl-benzamide Openeye Name: N-[(2S)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-methoxy-3-sulfamoyl-benzamide CAS Name: N-[(2S)-2-(2-furanyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-4-methoxy-3-sulfamoylbenzamide IUPAC Name: N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-ylethyl]-4-methoxy-3-sulfamoylbenzamide Traditional Name: N-[(2S)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-methoxy-3-sulfamoyl-benzamide Formula: C18H24N3O5S+ MolecularWeight: 394.46526

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23N3O5S/c1-25-16-7-6-13(11-17(16)27(19,23)24)18(22)20-12-14(15-5-4-10-26-15)21-8-2-3-9-21/h4-7,10-11,14H,2-3,8-9,12H2,1H3,(H,20,22)(H2,19,23,24)/p+1/t14-/m0/s1