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

Systemtic Name: N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-1-ium-4-yl]-3-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[1-(2-amino-2-oxo-ethyl)piperidin-1-ium-4-yl]-3-morpholinosulfonyl-benzamide CAS Name: N-[1-(2-amino-2-oxoethyl)-4-piperidin-1-iumyl]-3-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[1-(2-amino-2-oxoethyl)piperidin-1-ium-4-yl]-3-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[1-(2-amino-2-keto-ethyl)piperidin-1-ium-4-yl]-3-morpholinosulfonyl-benzamide Formula: C18H27N4O5S+ MolecularWeight: 411.49578

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)CC(=O)N

Isomeric SMILES

C1C[NH+](CCC1NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)CC(=O)N

InChI

InChI=1S/C18H26N4O5S/c19-17(23)13-21-6-4-15(5-7-21)20-18(24)14-2-1-3-16(12-14)28(25,26)22-8-10-27-11-9-22/h1-3,12,15H,4-11,13H2,(H2,19,23)(H,20,24)/p+1