N-(5-morpholin-4-ylsulfonyl-2-phenoxy-phenyl)-2-nitro-cyclopropane-1-carboxamide

Systemtic Name: N-(5-morpholin-4-ylsulfonyl-2-phenoxy-phenyl)-2-nitro-cyclopropane-1-carboxamide Openeye Name: N-(5-morpholinosulfonyl-2-phenoxy-phenyl)-2-nitro-cyclopropanecarboxamide CAS Name: N-[5-(4-morpholinylsulfonyl)-2-phenoxyphenyl]-2-nitro-1-cyclopropanecarboxamide IUPAC Name: N-(5-morpholin-4-ylsulfonyl-2-phenoxyphenyl)-2-nitrocyclopropane-1-carboxamide Traditional Name: N-(5-morpholinosulfonyl-2-phenoxy-phenyl)-2-nitro-cyclopropanecarboxamide Formula: C20H21N3O7S MolecularWeight: 447.46164

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)OC3=CC=CC=C3)NC(=O)C4CC4[N+](=O)[O-]

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)OC3=CC=CC=C3)NC(=O)C4CC4[N+](=O)[O-]

InChI

InChI=1S/C20H21N3O7S/c24-20(16-13-18(16)23(25)26)21-17-12-15(31(27,28)22-8-10-29-11-9-22)6-7-19(17)30-14-4-2-1-3-5-14/h1-7,12,16,18H,8-11,13H2,(H,21,24)