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

Systemtic Name: 2-[(2-methoxy-5-nitro-phenyl)-methylsulfonyl-amino]-N-[(4-morpholin-4-ylphenyl)methyl]ethanamide Openeye Name: 2-(2-methoxy-N-methylsulfonyl-5-nitro-anilino)-N-[(4-morpholinophenyl)methyl]acetamide CAS Name: 2-(2-methoxy-N-methylsulfonyl-5-nitroanilino)-N-[[4-(4-morpholinyl)phenyl]methyl]acetamide IUPAC Name: 2-(2-methoxy-N-methylsulfonyl-5-nitroanilino)-N-[(4-morpholin-4-ylphenyl)methyl]acetamide Traditional Name: 2-(N-mesyl-2-methoxy-5-nitro-anilino)-N-(4-morpholinobenzyl)acetamide Formula: C21H26N4O7S MolecularWeight: 478.51874

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])N(CC(=O)NCC2=CC=C(C=C2)N3CCOCC3)S(=O)(=O)C

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])N(CC(=O)NCC2=CC=C(C=C2)N3CCOCC3)S(=O)(=O)C

InChI

InChI=1S/C21H26N4O7S/c1-31-20-8-7-18(25(27)28)13-19(20)24(33(2,29)30)15-21(26)22-14-16-3-5-17(6-4-16)23-9-11-32-12-10-23/h3-8,13H,9-12,14-15H2,1-2H3,(H,22,26)