methyl 3-[2-(4-chloranylphenoxy)quinolin-6-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: methyl 3-[2-(4-chloranylphenoxy)quinolin-6-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: methyl 2-(tert-butoxycarbonylamino)-3-[2-(4-chlorophenoxy)-6-quinolyl]propanoate CAS Name: 3-[2-(4-chlorophenoxy)-6-quinolinyl]-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-[2-(4-chlorophenoxy)quinolin-6-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: 2-(tert-butoxycarbonylamino)-3-[2-(4-chlorophenoxy)-6-quinolyl]propionic acid methyl ester Formula: C24H25ClN2O5 MolecularWeight: 456.9187

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC2=C(C=C1)N=C(C=C2)OC3=CC=C(C=C3)Cl)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC2=C(C=C1)N=C(C=C2)OC3=CC=C(C=C3)Cl)C(=O)OC

InChI

InChI=1S/C24H25ClN2O5/c1-24(2,3)32-23(29)27-20(22(28)30-4)14-15-5-11-19-16(13-15)6-12-21(26-19)31-18-9-7-17(25)8-10-18/h5-13,20H,14H2,1-4H3,(H,27,29)