2-methoxy-N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]-5-sulfamoyl-benzamide

Systemtic Name: 2-methoxy-N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]-5-sulfamoyl-benzamide Openeye Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-2-methoxy-5-sulfamoyl-benzamide CAS Name: 2-methoxy-N-[(3S)-1-(phenylmethyl)-3-pyrrolidin-1-iumyl]-5-sulfamoylbenzamide IUPAC Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-2-methoxy-5-sulfamoylbenzamide Traditional Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-2-methoxy-5-sulfamoyl-benzamide Formula: C19H24N3O4S+ MolecularWeight: 390.47656

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N)C(=O)NC2CC[NH+](C2)CC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N)C(=O)N[C@H]2CC[NH+](C2)CC3=CC=CC=C3

InChI

InChI=1S/C19H23N3O4S/c1-26-18-8-7-16(27(20,24)25)11-17(18)19(23)21-15-9-10-22(13-15)12-14-5-3-2-4-6-14/h2-8,11,15H,9-10,12-13H2,1H3,(H,21,23)(H2,20,24,25)/p+1/t15-/m0/s1