5-(dimethylamino)-N-[[4-(3-phenylquinoxalin-2-yl)phenyl]methyl]naphthalene-2-sulfonamide; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: 5-(dimethylamino)-N-[[4-(3-phenylquinoxalin-2-yl)phenyl]methyl]naphthalene-2-sulfonamide; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 5-(dimethylamino)-N-[[4-(3-phenylquinoxalin-2-yl)phenyl]methyl]naphthalene-2-sulfonamide; 2,2,2-trifluoroacetic acid CAS Name: 5-(dimethylamino)-N-[[4-(3-phenyl-2-quinoxalinyl)phenyl]methyl]-2-naphthalenesulfonamide; 2,2,2-trifluoroacetic acid IUPAC Name: 5-(dimethylamino)-N-[[4-(3-phenylquinoxalin-2-yl)phenyl]methyl]naphthalene-2-sulfonamide; 2,2,2-trifluoroacetic acid Traditional Name: 5-(dimethylamino)-N-[4-(3-phenylquinoxalin-2-yl)benzyl]naphthalene-2-sulfonamide; 2,2,2-trifluoroacetic acid Formula: C35H29F3N4O4S MolecularWeight: 658.68937

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC2=C1C=CC(=C2)S(=O)(=O)NCC3=CC=C(C=C3)C4=NC5=CC=CC=C5N=C4C6=CC=CC=C6.C(=O)(C(F)(F)F)O

Isomeric SMILES

CN(C)C1=CC=CC2=C1C=CC(=C2)S(=O)(=O)NCC3=CC=C(C=C3)C4=NC5=CC=CC=C5N=C4C6=CC=CC=C6.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C33H28N4O2S.C2HF3O2/c1-37(2)31-14-8-11-26-21-27(19-20-28(26)31)40(38,39)34-22-23-15-17-25(18-16-23)33-32(24-9-4-3-5-10-24)35-29-12-6-7-13-30(29)36-33;3-2(4,5)1(6)7/h3-21,34H,22H2,1-2H3;(H,6,7)