(3-phenylisoquinolin-4-yl) 2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: (3-phenylisoquinolin-4-yl) 2-(phenylmethoxycarbonylamino)propanoate Openeye Name: (3-phenyl-4-isoquinolyl) 2-(benzyloxycarbonylamino)propanoate CAS Name: 2-(phenylmethoxycarbonylamino)propanoic acid (3-phenyl-4-isoquinolinyl) ester IUPAC Name: (3-phenylisoquinolin-4-yl) 2-(phenylmethoxycarbonylamino)propanoate Traditional Name: 2-(benzyloxycarbonylamino)propionic acid (3-phenyl-4-isoquinolyl) ester Formula: C26H22N2O4 MolecularWeight: 426.46388

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC1=C(N=CC2=CC=CC=C21)C3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC(C(=O)OC1=C(N=CC2=CC=CC=C21)C3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C26H22N2O4/c1-18(28-26(30)31-17-19-10-4-2-5-11-19)25(29)32-24-22-15-9-8-14-21(22)16-27-23(24)20-12-6-3-7-13-20/h2-16,18H,17H2,1H3,(H,28,30)