[4-(5-morpholin-4-ylsulfonylpyridin-1-ium-2-yl)piperazin-1-yl]-quinolin-8-yl-methanone

Systemtic Name: [4-(5-morpholin-4-ylsulfonylpyridin-1-ium-2-yl)piperazin-1-yl]-quinolin-8-yl-methanone Openeye Name: [4-(5-morpholinosulfonylpyridin-1-ium-2-yl)piperazin-1-yl]-(8-quinolyl)methanone CAS Name: [4-[5-(4-morpholinylsulfonyl)-2-pyridin-1-iumyl]-1-piperazinyl]-(8-quinolinyl)methanone IUPAC Name: [4-(5-morpholin-4-ylsulfonylpyridin-1-ium-2-yl)piperazin-1-yl]-quinolin-8-ylmethanone Traditional Name: [4-(5-morpholinosulfonylpyridin-1-ium-2-yl)piperazino]-(8-quinolyl)methanone Formula: C23H26N5O4S+ MolecularWeight: 468.54864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=[NH+]C=C(C=C2)S(=O)(=O)N3CCOCC3)C(=O)C4=CC=CC5=C4N=CC=C5

Isomeric SMILES

C1CN(CCN1C2=[NH+]C=C(C=C2)S(=O)(=O)N3CCOCC3)C(=O)C4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C23H25N5O4S/c29-23(20-5-1-3-18-4-2-8-24-22(18)20)27-11-9-26(10-12-27)21-7-6-19(17-25-21)33(30,31)28-13-15-32-16-14-28/h1-8,17H,9-16H2/p+1