N-(4-ethoxy-2-nitro-phenyl)-1-(4-ethoxyphenyl)sulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(4-ethoxy-2-nitro-phenyl)-1-(4-ethoxyphenyl)sulfonyl-pyrrolidine-2-carboxamide Openeye Name: N-(4-ethoxy-2-nitro-phenyl)-1-(4-ethoxyphenyl)sulfonyl-pyrrolidine-2-carboxamide CAS Name: N-(4-ethoxy-2-nitrophenyl)-1-(4-ethoxyphenyl)sulfonyl-2-pyrrolidinecarboxamide IUPAC Name: N-(4-ethoxy-2-nitrophenyl)-1-(4-ethoxyphenyl)sulfonylpyrrolidine-2-carboxamide Traditional Name: N-(4-ethoxy-2-nitro-phenyl)-1-p-phenetylsulfonyl-pyrrolidine-2-carboxamide Formula: C21H25N3O7S MolecularWeight: 463.5041

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NC3=C(C=C(C=C3)OCC)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NC3=C(C=C(C=C3)OCC)[N+](=O)[O-]

InChI

InChI=1S/C21H25N3O7S/c1-3-30-15-7-10-17(11-8-15)32(28,29)23-13-5-6-19(23)21(25)22-18-12-9-16(31-4-2)14-20(18)24(26)27/h7-12,14,19H,3-6,13H2,1-2H3,(H,22,25)