4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-N-(2-morpholin-4-ium-4-ylethyl)benzamide

Systemtic Name: 4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-N-(2-morpholin-4-ium-4-ylethyl)benzamide Openeye Name: 4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-N-(2-morpholin-4-ium-4-ylethyl)benzamide CAS Name: 4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-N-[2-(4-morpholin-4-iumyl)ethyl]benzamide IUPAC Name: 4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-N-(2-morpholin-4-ium-4-ylethyl)benzamide Traditional Name: 4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-N-(2-morpholin-4-ium-4-ylethyl)benzamide Formula: C22H28N3O4S+ MolecularWeight: 430.54042

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C1)S(=O)(=O)C3=CC=C(C=C3)C(=O)NCC[NH+]4CCOCC4

Isomeric SMILES

C1CC2=CC=CC=C2N(C1)S(=O)(=O)C3=CC=C(C=C3)C(=O)NCC[NH+]4CCOCC4

InChI

InChI=1S/C22H27N3O4S/c26-22(23-11-13-24-14-16-29-17-15-24)19-7-9-20(10-8-19)30(27,28)25-12-3-5-18-4-1-2-6-21(18)25/h1-2,4,6-10H,3,5,11-17H2,(H,23,26)/p+1