N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-1-ium-4-yl]-4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzamide

Systemtic Name: N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-1-ium-4-yl]-4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzamide Openeye Name: N-[1-(2-amino-2-oxo-ethyl)piperidin-1-ium-4-yl]-4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzamide CAS Name: N-[1-(2-amino-2-oxoethyl)-4-piperidin-1-iumyl]-4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzamide IUPAC Name: N-[1-(2-amino-2-oxoethyl)piperidin-1-ium-4-yl]-4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzamide Traditional Name: N-[1-(2-amino-2-keto-ethyl)piperidin-1-ium-4-yl]-4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzamide Formula: C23H29N4O4S+ MolecularWeight: 457.56576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C1)S(=O)(=O)C3=CC=C(C=C3)C(=O)NC4CC[NH+](CC4)CC(=O)N

Isomeric SMILES

C1CC2=CC=CC=C2N(C1)S(=O)(=O)C3=CC=C(C=C3)C(=O)NC4CC[NH+](CC4)CC(=O)N

InChI

InChI=1S/C23H28N4O4S/c24-22(28)16-26-14-11-19(12-15-26)25-23(29)18-7-9-20(10-8-18)32(30,31)27-13-3-5-17-4-1-2-6-21(17)27/h1-2,4,6-10,19H,3,5,11-16H2,(H2,24,28)(H,25,29)/p+1