1-[2-methyl-4-[(4-methylsulfonyl-2-nitro-phenyl)amino]phenyl]pyrrolidin-2-one

Systemtic Name: 1-[2-methyl-4-[(4-methylsulfonyl-2-nitro-phenyl)amino]phenyl]pyrrolidin-2-one Openeye Name: 1-[2-methyl-4-(4-methylsulfonyl-2-nitro-anilino)phenyl]pyrrolidin-2-one CAS Name: 1-[2-methyl-4-(4-methylsulfonyl-2-nitroanilino)phenyl]-2-pyrrolidinone IUPAC Name: 1-[2-methyl-4-(4-methylsulfonyl-2-nitroanilino)phenyl]pyrrolidin-2-one Traditional Name: 1-[4-(4-mesyl-2-nitro-anilino)-2-methyl-phenyl]-2-pyrrolidone Formula: C18H19N3O5S MolecularWeight: 389.42556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-])N3CCCC3=O

Isomeric SMILES

CC1=C(C=CC(=C1)NC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-])N3CCCC3=O

InChI

InChI=1S/C18H19N3O5S/c1-12-10-13(5-8-16(12)20-9-3-4-18(20)22)19-15-7-6-14(27(2,25)26)11-17(15)21(23)24/h5-8,10-11,19H,3-4,9H2,1-2H3