N,N-dimethyl-4-[(2-methyl-3-nitro-phenyl)methylsulfonyl]butanamide

Systemtic Name: N,N-dimethyl-4-[(2-methyl-3-nitro-phenyl)methylsulfonyl]butanamide Openeye Name: N,N-dimethyl-4-[(2-methyl-3-nitro-phenyl)methylsulfonyl]butanamide CAS Name: N,N-dimethyl-4-[(2-methyl-3-nitrophenyl)methylsulfonyl]butanamide IUPAC Name: N,N-dimethyl-4-[(2-methyl-3-nitrophenyl)methylsulfonyl]butanamide Traditional Name: N,N-dimethyl-4-(2-methyl-3-nitro-benzyl)sulfonyl-butyramide Formula: C14H20N2O5S MolecularWeight: 328.384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])CS(=O)(=O)CCCC(=O)N(C)C

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])CS(=O)(=O)CCCC(=O)N(C)C

InChI

InChI=1S/C14H20N2O5S/c1-11-12(6-4-7-13(11)16(18)19)10-22(20,21)9-5-8-14(17)15(2)3/h4,6-7H,5,8-10H2,1-3H3