2-[1-(4-phenoxyphenyl)carbonylisoquinolin-4-yl]ethanoic acid

Systemtic Name: 2-[1-(4-phenoxyphenyl)carbonylisoquinolin-4-yl]ethanoic acid Openeye Name: 2-[1-(4-phenoxybenzoyl)-4-isoquinolyl]acetic acid CAS Name: 2-[1-[oxo-(4-phenoxyphenyl)methyl]-4-isoquinolinyl]acetic acid IUPAC Name: 2-[1-(4-phenoxybenzoyl)isoquinolin-4-yl]acetic acid Traditional Name: 2-[1-(4-phenoxybenzoyl)-4-isoquinolyl]acetic acid Formula: C24H17NO4 MolecularWeight: 383.39608

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)C(=O)C3=NC=C(C4=CC=CC=C43)CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)C(=O)C3=NC=C(C4=CC=CC=C43)CC(=O)O

InChI

InChI=1S/C24H17NO4/c26-22(27)14-17-15-25-23(21-9-5-4-8-20(17)21)24(28)16-10-12-19(13-11-16)29-18-6-2-1-3-7-18/h1-13,15H,14H2,(H,26,27)