methyl 2-(phenylmethoxycarbonylamino)-3-(quinolin-2-ylcarbonylamino)propanoate

Systemtic Name: methyl 2-(phenylmethoxycarbonylamino)-3-(quinolin-2-ylcarbonylamino)propanoate Openeye Name: methyl 2-(benzyloxycarbonylamino)-3-(quinoline-2-carbonylamino)propanoate CAS Name: 3-[[oxo(2-quinolinyl)methyl]amino]-2-(phenylmethoxycarbonylamino)propanoic acid methyl ester IUPAC Name: methyl 2-(phenylmethoxycarbonylamino)-3-(quinoline-2-carbonylamino)propanoate Traditional Name: 2-(benzyloxycarbonylamino)-3-(quinaldoylamino)propionic acid methyl ester Formula: C22H21N3O5 MolecularWeight: 407.41924

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CNC(=O)C1=NC2=CC=CC=C2C=C1)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

COC(=O)C(CNC(=O)C1=NC2=CC=CC=C2C=C1)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H21N3O5/c1-29-21(27)19(25-22(28)30-14-15-7-3-2-4-8-15)13-23-20(26)18-12-11-16-9-5-6-10-17(16)24-18/h2-12,19H,13-14H2,1H3,(H,23,26)(H,25,28)