N-(2,4-dichlorophenyl)-2-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]propanamide

Systemtic Name: N-(2,4-dichlorophenyl)-2-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]propanamide Openeye Name: N-(2,4-dichlorophenyl)-2-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]propanamide CAS Name: N-(2,4-dichlorophenyl)-2-[4-(2-nitrophenyl)sulfonyl-1-piperazinyl]propanamide IUPAC Name: N-(2,4-dichlorophenyl)-2-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]propanamide Traditional Name: N-(2,4-dichlorophenyl)-2-[4-(2-nitrophenyl)sulfonylpiperazino]propionamide Formula: C19H20Cl2N4O5S MolecularWeight: 487.3569

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)Cl)Cl)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NC1=C(C=C(C=C1)Cl)Cl)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C19H20Cl2N4O5S/c1-13(19(26)22-16-7-6-14(20)12-15(16)21)23-8-10-24(11-9-23)31(29,30)18-5-3-2-4-17(18)25(27)28/h2-7,12-13H,8-11H2,1H3,(H,22,26)