2-[[4-(2-indol-1-ylethoxy)phenyl]methyl]propanedioic acid

Systemtic Name: 2-[[4-(2-indol-1-ylethoxy)phenyl]methyl]propanedioic acid Openeye Name: 2-[[4-(2-indol-1-ylethoxy)phenyl]methyl]propanedioic acid CAS Name: 2-[[4-[2-(1-indolyl)ethoxy]phenyl]methyl]propanedioic acid IUPAC Name: 2-[[4-(2-indol-1-ylethoxy)phenyl]methyl]propanedioic acid Traditional Name: 2-[4-(2-indol-1-ylethoxy)benzyl]malonic acid Formula: C20H19NO5 MolecularWeight: 353.36856

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CN2CCOC3=CC=C(C=C3)CC(C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CN2CCOC3=CC=C(C=C3)CC(C(=O)O)C(=O)O

InChI

InChI=1S/C20H19NO5/c22-19(23)17(20(24)25)13-14-5-7-16(8-6-14)26-12-11-21-10-9-15-3-1-2-4-18(15)21/h1-10,17H,11-13H2,(H,22,23)(H,24,25)