4-(1-butyl-3-oxidanyl-2-oxidanylidene-pyrrolidin-3-yl)-5-(3-methyl-2H-1,2-oxazol-5-ylidene)pyrrole-2-carboxylic acid

Systemtic Name: 4-(1-butyl-3-oxidanyl-2-oxidanylidene-pyrrolidin-3-yl)-5-(3-methyl-2H-1,2-oxazol-5-ylidene)pyrrole-2-carboxylic acid Openeye Name: 4-(1-butyl-3-hydroxy-2-oxo-pyrrolidin-3-yl)-5-(3-methyl-2H-isoxazol-5-ylidene)pyrrole-2-carboxylic acid CAS Name: 4-(1-butyl-3-hydroxy-2-oxo-3-pyrrolidinyl)-5-(3-methyl-2H-isoxazol-5-ylidene)-2-pyrrolecarboxylic acid IUPAC Name: 4-(1-butyl-3-hydroxy-2-oxopyrrolidin-3-yl)-5-(3-methyl-2H-1,2-oxazol-5-ylidene)pyrrole-2-carboxylic acid Traditional Name: 4-(1-butyl-3-hydroxy-2-keto-pyrrolidin-3-yl)-5-(3-methyl-3-isoxazolin-5-ylidene)pyrrole-2-carboxylic acid Formula: C17H21N3O5 MolecularWeight: 347.36574

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCC(C1=O)(C2=CC(=NC2=C3C=C(NO3)C)C(=O)O)O

Isomeric SMILES

CCCCN1CCC(C1=O)(C2=CC(=NC2=C3C=C(NO3)C)C(=O)O)O

InChI

InChI=1S/C17H21N3O5/c1-3-4-6-20-7-5-17(24,16(20)23)11-9-12(15(21)22)18-14(11)13-8-10(2)19-25-13/h8-9,19,24H,3-7H2,1-2H3,(H,21,22)