N,N-diethyl-3-nitro-4-(2-quinolin-8-ylethylamino)benzenesulfonamide

Systemtic Name: N,N-diethyl-3-nitro-4-(2-quinolin-8-ylethylamino)benzenesulfonamide Openeye Name: N,N-diethyl-3-nitro-4-[2-(8-quinolyl)ethylamino]benzenesulfonamide CAS Name: N,N-diethyl-3-nitro-4-[2-(8-quinolinyl)ethylamino]benzenesulfonamide IUPAC Name: N,N-diethyl-3-nitro-4-(2-quinolin-8-ylethylamino)benzenesulfonamide Traditional Name: N,N-diethyl-3-nitro-4-[2-(8-quinolyl)ethylamino]benzenesulfonamide Formula: C21H24N4O4S MolecularWeight: 428.50466

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)NCCC2=CC=CC3=C2N=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)NCCC2=CC=CC3=C2N=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H24N4O4S/c1-3-24(4-2)30(28,29)18-10-11-19(20(15-18)25(26)27)22-14-12-17-8-5-7-16-9-6-13-23-21(16)17/h5-11,13,15,22H,3-4,12,14H2,1-2H3