N-(4-azanyl-2-chloranyl-5-nitro-phenyl)-N-(2-diethylaminoethyl)benzenesulfonamide

Systemtic Name: N-(4-azanyl-2-chloranyl-5-nitro-phenyl)-N-(2-diethylaminoethyl)benzenesulfonamide Openeye Name: N-(4-amino-2-chloro-5-nitro-phenyl)-N-(2-diethylaminoethyl)benzenesulfonamide CAS Name: N-(4-amino-2-chloro-5-nitrophenyl)-N-(2-diethylaminoethyl)benzenesulfonamide IUPAC Name: N-(4-amino-2-chloro-5-nitrophenyl)-N-(2-diethylaminoethyl)benzenesulfonamide Traditional Name: N-(4-amino-2-chloro-5-nitro-phenyl)-N-(2-diethylaminoethyl)benzenesulfonamide Formula: C18H23ClN4O4S MolecularWeight: 426.91762

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(C1=CC(=C(C=C1Cl)N)[N+](=O)[O-])S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CCN(CC)CCN(C1=CC(=C(C=C1Cl)N)[N+](=O)[O-])S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H23ClN4O4S/c1-3-21(4-2)10-11-22(28(26,27)14-8-6-5-7-9-14)17-13-18(23(24)25)16(20)12-15(17)19/h5-9,12-13H,3-4,10-11,20H2,1-2H3