2-[[4-(quinolin-3-ylmethoxy)phenyl]methyl]propanedioate

Systemtic Name: 2-[[4-(quinolin-3-ylmethoxy)phenyl]methyl]propanedioate Openeye Name: 2-[[4-(3-quinolylmethoxy)phenyl]methyl]propanedioate CAS Name: 2-[[4-(3-quinolinylmethoxy)phenyl]methyl]propanedioate IUPAC Name: 2-[[4-(quinolin-3-ylmethoxy)phenyl]methyl]propanedioate Traditional Name: 2-[4-(3-quinolylmethoxy)benzyl]malonate Formula: C20H15NO5-2 MolecularWeight: 349.3368

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C=N2)COC3=CC=C(C=C3)CC(C(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C=N2)COC3=CC=C(C=C3)CC(C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C20H17NO5/c22-19(23)17(20(24)25)10-13-5-7-16(8-6-13)26-12-14-9-15-3-1-2-4-18(15)21-11-14/h1-9,11,17H,10,12H2,(H,22,23)(H,24,25)/p-2