N-butyl-2-[(2-methoxy-5-nitro-phenyl)-methylsulfonyl-amino]ethanamide

Systemtic Name: N-butyl-2-[(2-methoxy-5-nitro-phenyl)-methylsulfonyl-amino]ethanamide Openeye Name: N-butyl-2-(2-methoxy-N-methylsulfonyl-5-nitro-anilino)acetamide CAS Name: N-butyl-2-(2-methoxy-N-methylsulfonyl-5-nitroanilino)acetamide IUPAC Name: N-butyl-2-(2-methoxy-N-methylsulfonyl-5-nitroanilino)acetamide Traditional Name: N-butyl-2-(N-mesyl-2-methoxy-5-nitro-anilino)acetamide Formula: C14H21N3O6S MolecularWeight: 359.39804

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CN(C1=C(C=CC(=C1)[N+](=O)[O-])OC)S(=O)(=O)C

Isomeric SMILES

CCCCNC(=O)CN(C1=C(C=CC(=C1)[N+](=O)[O-])OC)S(=O)(=O)C

InChI

InChI=1S/C14H21N3O6S/c1-4-5-8-15-14(18)10-16(24(3,21)22)12-9-11(17(19)20)6-7-13(12)23-2/h6-7,9H,4-5,8,10H2,1-3H3,(H,15,18)