4-[1-(3,4-dichlorophenyl)ethylamino]-N-(2-dimethylaminoethyl)-3-nitro-benzenesulfonamide

Systemtic Name: 4-[1-(3,4-dichlorophenyl)ethylamino]-N-(2-dimethylaminoethyl)-3-nitro-benzenesulfonamide Openeye Name: 4-[1-(3,4-dichlorophenyl)ethylamino]-N-(2-dimethylaminoethyl)-3-nitro-benzenesulfonamide CAS Name: 4-[1-(3,4-dichlorophenyl)ethylamino]-N-(2-dimethylaminoethyl)-3-nitrobenzenesulfonamide IUPAC Name: 4-[1-(3,4-dichlorophenyl)ethylamino]-N-(2-dimethylaminoethyl)-3-nitrobenzenesulfonamide Traditional Name: 4-[1-(3,4-dichlorophenyl)ethylamino]-N-(2-dimethylaminoethyl)-3-nitro-benzenesulfonamide Formula: C18H22Cl2N4O4S MolecularWeight: 461.36268

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)Cl)Cl)NC2=C(C=C(C=C2)S(=O)(=O)NCCN(C)C)[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC(=C(C=C1)Cl)Cl)NC2=C(C=C(C=C2)S(=O)(=O)NCCN(C)C)[N+](=O)[O-]

InChI

InChI=1S/C18H22Cl2N4O4S/c1-12(13-4-6-15(19)16(20)10-13)22-17-7-5-14(11-18(17)24(25)26)29(27,28)21-8-9-23(2)3/h4-7,10-12,21-22H,8-9H2,1-3H3