4-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-3-nitro-N-propan-2-yl-benzenesulfonamide

Systemtic Name: 4-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-3-nitro-N-propan-2-yl-benzenesulfonamide Openeye Name: 4-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-N-isopropyl-3-nitro-benzenesulfonamide CAS Name: 4-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-3-nitro-N-propan-2-ylbenzenesulfonamide IUPAC Name: 4-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-3-nitro-N-propan-2-ylbenzenesulfonamide Traditional Name: 4-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-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)NC(C)C2=CC=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C17H20ClN3O4S/c1-11(2)20-26(24,25)15-8-9-16(17(10-15)21(22)23)19-12(3)13-4-6-14(18)7-5-13/h4-12,19-20H,1-3H3/t12-/m1/s1