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

Systemtic Name: N-[1-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]piperidin-1-ium-4-yl]-4-methoxy-3-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[1-[2-(cyclopropylamino)-2-oxo-ethyl]piperidin-1-ium-4-yl]-4-methoxy-3-morpholinosulfonyl-benzamide CAS Name: N-[1-[2-(cyclopropylamino)-2-oxoethyl]-4-piperidin-1-iumyl]-4-methoxy-3-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[1-[2-(cyclopropylamino)-2-oxoethyl]piperidin-1-ium-4-yl]-4-methoxy-3-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[1-[2-(cyclopropylamino)-2-keto-ethyl]piperidin-1-ium-4-yl]-4-methoxy-3-morpholinosulfonyl-benzamide Formula: C22H33N4O6S+ MolecularWeight: 481.58562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2CC[NH+](CC2)CC(=O)NC3CC3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2CC[NH+](CC2)CC(=O)NC3CC3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C22H32N4O6S/c1-31-19-5-2-16(14-20(19)33(29,30)26-10-12-32-13-11-26)22(28)24-18-6-8-25(9-7-18)15-21(27)23-17-3-4-17/h2,5,14,17-18H,3-4,6-13,15H2,1H3,(H,23,27)(H,24,28)/p+1