4-[(4-cyanophenyl)methoxy]-3-methyl-1-benzofuran-2-carboxylic acid

Systemtic Name: 4-[(4-cyanophenyl)methoxy]-3-methyl-1-benzofuran-2-carboxylic acid Openeye Name: 4-[(4-cyanophenyl)methoxy]-3-methyl-benzofuran-2-carboxylic acid CAS Name: 4-[(4-cyanophenyl)methoxy]-3-methyl-2-benzofurancarboxylic acid IUPAC Name: 4-[(4-cyanophenyl)methoxy]-3-methyl-1-benzofuran-2-carboxylic acid Traditional Name: 4-(4-cyanobenzyl)oxy-3-methyl-coumarilic acid Formula: C18H13NO4 MolecularWeight: 307.30012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=CC=C2)OCC3=CC=C(C=C3)C#N)C(=O)O

Isomeric SMILES

CC1=C(OC2=C1C(=CC=C2)OCC3=CC=C(C=C3)C#N)C(=O)O

InChI

InChI=1S/C18H13NO4/c1-11-16-14(3-2-4-15(16)23-17(11)18(20)21)22-10-13-7-5-12(9-19)6-8-13/h2-8H,10H2,1H3,(H,20,21)