2-[4-(5-methyl-2-phenyl-1,3-oxazol-4-yl)butyl]propanedioate

Systemtic Name: 2-[4-(5-methyl-2-phenyl-1,3-oxazol-4-yl)butyl]propanedioate Openeye Name: 2-[4-(5-methyl-2-phenyl-oxazol-4-yl)butyl]propanedioate CAS Name: 2-[4-(5-methyl-2-phenyl-4-oxazolyl)butyl]propanedioate IUPAC Name: 2-[4-(5-methyl-2-phenyl-1,3-oxazol-4-yl)butyl]propanedioate Traditional Name: 2-[4-(5-methyl-2-phenyl-oxazol-4-yl)butyl]malonate Formula: C17H17NO5-2 MolecularWeight: 315.32058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=CC=C2)CCCCC(C(=O)[O-])C(=O)[O-]

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=CC=C2)CCCCC(C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C17H19NO5/c1-11-14(10-6-5-9-13(16(19)20)17(21)22)18-15(23-11)12-7-3-2-4-8-12/h2-4,7-8,13H,5-6,9-10H2,1H3,(H,19,20)(H,21,22)/p-2