2-[[4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]carbonylamino]ethyl-diethyl-azanium

Systemtic Name: 2-[[4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]carbonylamino]ethyl-diethyl-azanium Openeye Name: 2-[[4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzoyl]amino]ethyl-diethyl-ammonium CAS Name: 2-[[[4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]-oxomethyl]amino]ethyl-diethylammonium IUPAC Name: 2-[[4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzoyl]amino]ethyl-diethylazanium Traditional Name: 2-[[4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzoyl]amino]ethyl-diethyl-ammonium Formula: C22H30N3O3S+ MolecularWeight: 416.5569

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCC3=CC=CC=C32

Isomeric SMILES

CC[NH+](CC)CCNC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCC3=CC=CC=C32

InChI

InChI=1S/C22H29N3O3S/c1-3-24(4-2)17-15-23-22(26)19-11-13-20(14-12-19)29(27,28)25-16-7-9-18-8-5-6-10-21(18)25/h5-6,8,10-14H,3-4,7,9,15-17H2,1-2H3,(H,23,26)/p+1