2-[(2-methoxy-5-nitro-phenyl)-methylsulfonyl-amino]-N-[(4-propan-2-yloxyphenyl)methyl]ethanamide

Systemtic Name: 2-[(2-methoxy-5-nitro-phenyl)-methylsulfonyl-amino]-N-[(4-propan-2-yloxyphenyl)methyl]ethanamide Openeye Name: N-[(4-isopropoxyphenyl)methyl]-2-(2-methoxy-N-methylsulfonyl-5-nitro-anilino)acetamide CAS Name: 2-(2-methoxy-N-methylsulfonyl-5-nitroanilino)-N-[(4-propan-2-yloxyphenyl)methyl]acetamide IUPAC Name: 2-(2-methoxy-N-methylsulfonyl-5-nitroanilino)-N-[(4-propan-2-yloxyphenyl)methyl]acetamide Traditional Name: N-(4-isopropoxybenzyl)-2-(N-mesyl-2-methoxy-5-nitro-anilino)acetamide Formula: C20H25N3O7S MolecularWeight: 451.4934

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)CNC(=O)CN(C2=C(C=CC(=C2)[N+](=O)[O-])OC)S(=O)(=O)C

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)CNC(=O)CN(C2=C(C=CC(=C2)[N+](=O)[O-])OC)S(=O)(=O)C

InChI

InChI=1S/C20H25N3O7S/c1-14(2)30-17-8-5-15(6-9-17)12-21-20(24)13-22(31(4,27)28)18-11-16(23(25)26)7-10-19(18)29-3/h5-11,14H,12-13H2,1-4H3,(H,21,24)