4-[2-(4-chlorophenyl)ethylamino]-3-nitro-N-propan-2-yl-benzenesulfonamide

Systemtic Name: 4-[2-(4-chlorophenyl)ethylamino]-3-nitro-N-propan-2-yl-benzenesulfonamide Openeye Name: 4-[2-(4-chlorophenyl)ethylamino]-N-isopropyl-3-nitro-benzenesulfonamide CAS Name: 4-[2-(4-chlorophenyl)ethylamino]-3-nitro-N-propan-2-ylbenzenesulfonamide IUPAC Name: 4-[2-(4-chlorophenyl)ethylamino]-3-nitro-N-propan-2-ylbenzenesulfonamide Traditional Name: 4-[2-(4-chlorophenyl)ethylamino]-N-isopropyl-3-nitro-benzenesulfonamide Formula: C17H20ClN3O4S MolecularWeight: 397.8764

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)NCCC2=CC=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)NCCC2=CC=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H20ClN3O4S/c1-12(2)20-26(24,25)15-7-8-16(17(11-15)21(22)23)19-10-9-13-3-5-14(18)6-4-13/h3-8,11-12,19-20H,9-10H2,1-2H3