4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)-N-(2-pyrrolidin-1-ylcarbonylphenyl)butanamide

Systemtic Name: 4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)-N-(2-pyrrolidin-1-ylcarbonylphenyl)butanamide Openeye Name: 4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)-N-[2-(pyrrolidine-1-carbonyl)phenyl]butanamide CAS Name: 4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)-N-[2-[oxo(1-pyrrolidinyl)methyl]phenyl]butanamide IUPAC Name: 4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)-N-[2-(pyrrolidine-1-carbonyl)phenyl]butanamide Traditional Name: 4-(2-keto-6-nitro-1,3-benzoxazol-3-yl)-N-[2-(pyrrolidine-1-carbonyl)phenyl]butyramide Formula: C22H22N4O6 MolecularWeight: 438.43328

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC=CC=C2NC(=O)CCCN3C4=C(C=C(C=C4)[N+](=O)[O-])OC3=O

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC=CC=C2NC(=O)CCCN3C4=C(C=C(C=C4)[N+](=O)[O-])OC3=O

InChI

InChI=1S/C22H22N4O6/c27-20(23-17-7-2-1-6-16(17)21(28)24-11-3-4-12-24)8-5-13-25-18-10-9-15(26(30)31)14-19(18)32-22(25)29/h1-2,6-7,9-10,14H,3-5,8,11-13H2,(H,23,27)