N-(2-ethoxy-5-morpholin-4-ylsulfonyl-phenyl)-2-methyl-5-nitro-benzenesulfonamide

Systemtic Name: N-(2-ethoxy-5-morpholin-4-ylsulfonyl-phenyl)-2-methyl-5-nitro-benzenesulfonamide Openeye Name: N-(2-ethoxy-5-morpholinosulfonyl-phenyl)-2-methyl-5-nitro-benzenesulfonamide CAS Name: N-[2-ethoxy-5-(4-morpholinylsulfonyl)phenyl]-2-methyl-5-nitrobenzenesulfonamide IUPAC Name: N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)-2-methyl-5-nitrobenzenesulfonamide Traditional Name: N-(2-ethoxy-5-morpholinosulfonyl-phenyl)-2-methyl-5-nitro-benzenesulfonamide Formula: C19H23N3O8S2 MolecularWeight: 485.53122

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NS(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])C

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NS(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])C

InChI

InChI=1S/C19H23N3O8S2/c1-3-30-18-7-6-16(32(27,28)21-8-10-29-11-9-21)13-17(18)20-31(25,26)19-12-15(22(23)24)5-4-14(19)2/h4-7,12-13,20H,3,8-11H2,1-2H3