methyl 2-[(8-oxidanylquinolin-7-yl)carbonylamino]-3-(4-phenylmethoxyphenyl)propanoate

Systemtic Name: methyl 2-[(8-oxidanylquinolin-7-yl)carbonylamino]-3-(4-phenylmethoxyphenyl)propanoate Openeye Name: methyl 3-(4-benzyloxyphenyl)-2-[(8-hydroxyquinoline-7-carbonyl)amino]propanoate CAS Name: 2-[[(8-hydroxy-7-quinolinyl)-oxomethyl]amino]-3-(4-phenylmethoxyphenyl)propanoic acid methyl ester IUPAC Name: methyl 2-[(8-hydroxyquinoline-7-carbonyl)amino]-3-(4-phenylmethoxyphenyl)propanoate Traditional Name: 3-(4-benzoxyphenyl)-2-[(8-hydroxyquinoline-7-carbonyl)amino]propionic acid methyl ester Formula: C27H24N2O5 MolecularWeight: 456.48986

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=C(C=C1)OCC2=CC=CC=C2)NC(=O)C3=C(C4=C(C=CC=N4)C=C3)O

Isomeric SMILES

COC(=O)C(CC1=CC=C(C=C1)OCC2=CC=CC=C2)NC(=O)C3=C(C4=C(C=CC=N4)C=C3)O

InChI

InChI=1S/C27H24N2O5/c1-33-27(32)23(29-26(31)22-14-11-20-8-5-15-28-24(20)25(22)30)16-18-9-12-21(13-10-18)34-17-19-6-3-2-4-7-19/h2-15,23,30H,16-17H2,1H3,(H,29,31)