N-(3-ethoxyphenyl)-2-[(2-methyl-5-nitro-phenyl)-methylsulfonyl-amino]ethanamide

Systemtic Name: N-(3-ethoxyphenyl)-2-[(2-methyl-5-nitro-phenyl)-methylsulfonyl-amino]ethanamide Openeye Name: N-(3-ethoxyphenyl)-2-(2-methyl-N-methylsulfonyl-5-nitro-anilino)acetamide CAS Name: N-(3-ethoxyphenyl)-2-(2-methyl-N-methylsulfonyl-5-nitroanilino)acetamide IUPAC Name: N-(3-ethoxyphenyl)-2-(2-methyl-N-methylsulfonyl-5-nitroanilino)acetamide Traditional Name: 2-(N-mesyl-2-methyl-5-nitro-anilino)-N-m-phenetyl-acetamide Formula: C18H21N3O6S MolecularWeight: 407.44084

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)NC(=O)CN(C2=C(C=CC(=C2)[N+](=O)[O-])C)S(=O)(=O)C

Isomeric SMILES

CCOC1=CC=CC(=C1)NC(=O)CN(C2=C(C=CC(=C2)[N+](=O)[O-])C)S(=O)(=O)C

InChI

InChI=1S/C18H21N3O6S/c1-4-27-16-7-5-6-14(10-16)19-18(22)12-20(28(3,25)26)17-11-15(21(23)24)9-8-13(17)2/h5-11H,4,12H2,1-3H3,(H,19,22)