N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-2-(5-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)ethanamide

Systemtic Name: N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-2-(5-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)ethanamide Openeye Name: N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-2-(5-nitro-2-oxo-1,3-benzoxazol-3-yl)acetamide CAS Name: N-[4-ethoxy-3-(1-pyrrolidinylsulfonyl)phenyl]-2-(5-nitro-2-oxo-1,3-benzoxazol-3-yl)acetamide IUPAC Name: N-(4-ethoxy-3-pyrrolidin-1-ylsulfonylphenyl)-2-(5-nitro-2-oxo-1,3-benzoxazol-3-yl)acetamide Traditional Name: N-(4-ethoxy-3-pyrrolidinosulfonyl-phenyl)-2-(2-keto-5-nitro-1,3-benzoxazol-3-yl)acetamide Formula: C21H22N4O8S MolecularWeight: 490.48638

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)CN2C3=C(C=CC(=C3)[N+](=O)[O-])OC2=O)S(=O)(=O)N4CCCC4

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)CN2C3=C(C=CC(=C3)[N+](=O)[O-])OC2=O)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C21H22N4O8S/c1-2-32-18-7-5-14(11-19(18)34(30,31)23-9-3-4-10-23)22-20(26)13-24-16-12-15(25(28)29)6-8-17(16)33-21(24)27/h5-8,11-12H,2-4,9-10,13H2,1H3,(H,22,26)