2-[(4-phenylisoquinolin-3-yl)carbonylamino]ethanoic acid

Systemtic Name: 2-[(4-phenylisoquinolin-3-yl)carbonylamino]ethanoic acid Openeye Name: 2-[(4-phenylisoquinoline-3-carbonyl)amino]acetic acid CAS Name: 2-[[oxo-(4-phenyl-3-isoquinolinyl)methyl]amino]acetic acid IUPAC Name: 2-[(4-phenylisoquinoline-3-carbonyl)amino]acetic acid Traditional Name: 2-[(4-phenylisoquinoline-3-carbonyl)amino]acetic acid Formula: C18H14N2O3 MolecularWeight: 306.31536

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N=CC3=CC=CC=C32)C(=O)NCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N=CC3=CC=CC=C32)C(=O)NCC(=O)O

InChI

InChI=1S/C18H14N2O3/c21-15(22)11-20-18(23)17-16(12-6-2-1-3-7-12)14-9-5-4-8-13(14)10-19-17/h1-10H,11H2,(H,20,23)(H,21,22)