6-(diethylsulfamoyl)-2-oxidanylidene-N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]-1H-quinoline-4-carboxamide

Systemtic Name: 6-(diethylsulfamoyl)-2-oxidanylidene-N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]-1H-quinoline-4-carboxamide Openeye Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-6-(diethylsulfamoyl)-2-oxo-1H-quinoline-4-carboxamide CAS Name: 6-(diethylsulfamoyl)-2-oxo-N-[(3S)-1-(phenylmethyl)-3-pyrrolidin-1-iumyl]-1H-quinoline-4-carboxamide IUPAC Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-6-(diethylsulfamoyl)-2-oxo-1H-quinoline-4-carboxamide Traditional Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-6-(diethylsulfamoyl)-2-keto-1H-quinoline-4-carboxamide Formula: C25H31N4O4S+ MolecularWeight: 483.60304

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)NC(=O)C=C2C(=O)NC3CC[NH+](C3)CC4=CC=CC=C4

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)NC(=O)C=C2C(=O)N[C@H]3CC[NH+](C3)CC4=CC=CC=C4

InChI

InChI=1S/C25H30N4O4S/c1-3-29(4-2)34(32,33)20-10-11-23-21(14-20)22(15-24(30)27-23)25(31)26-19-12-13-28(17-19)16-18-8-6-5-7-9-18/h5-11,14-15,19H,3-4,12-13,16-17H2,1-2H3,(H,26,31)(H,27,30)/p+1/t19-/m0/s1