N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-1-ium-4-yl]-3-[(2-methoxyphenyl)sulfamoyl]benzamide

Systemtic Name: N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-1-ium-4-yl]-3-[(2-methoxyphenyl)sulfamoyl]benzamide Openeye Name: N-[1-(2-amino-2-oxo-ethyl)piperidin-1-ium-4-yl]-3-[(2-methoxyphenyl)sulfamoyl]benzamide CAS Name: N-[1-(2-amino-2-oxoethyl)-4-piperidin-1-iumyl]-3-[(2-methoxyphenyl)sulfamoyl]benzamide IUPAC Name: N-[1-(2-amino-2-oxoethyl)piperidin-1-ium-4-yl]-3-[(2-methoxyphenyl)sulfamoyl]benzamide Traditional Name: N-[1-(2-amino-2-keto-ethyl)piperidin-1-ium-4-yl]-3-[(2-methoxyphenyl)sulfamoyl]benzamide Formula: C21H27N4O5S+ MolecularWeight: 447.52788

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NS(=O)(=O)C2=CC=CC(=C2)C(=O)NC3CC[NH+](CC3)CC(=O)N

Isomeric SMILES

COC1=CC=CC=C1NS(=O)(=O)C2=CC=CC(=C2)C(=O)NC3CC[NH+](CC3)CC(=O)N

InChI

InChI=1S/C21H26N4O5S/c1-30-19-8-3-2-7-18(19)24-31(28,29)17-6-4-5-15(13-17)21(27)23-16-9-11-25(12-10-16)14-20(22)26/h2-8,13,16,24H,9-12,14H2,1H3,(H2,22,26)(H,23,27)/p+1