(phenylmethyl) 3-cyano-3-[[4-methyl-2-(morpholin-4-ylcarbonylamino)pentanoyl]amino]propanoate

Systemtic Name: (phenylmethyl) 3-cyano-3-[[4-methyl-2-(morpholin-4-ylcarbonylamino)pentanoyl]amino]propanoate Openeye Name: benzyl 3-cyano-3-[[4-methyl-2-(morpholine-4-carbonylamino)pentanoyl]amino]propanoate CAS Name: 3-cyano-3-[[4-methyl-2-[[4-morpholinyl(oxo)methyl]amino]-1-oxopentyl]amino]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-cyano-3-[[4-methyl-2-(morpholine-4-carbonylamino)pentanoyl]amino]propanoate Traditional Name: 3-cyano-3-[[4-methyl-2-(morpholine-4-carbonylamino)pentanoyl]amino]propionic acid benzyl ester Formula: C22H30N4O5 MolecularWeight: 430.4974

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC(=O)OCC1=CC=CC=C1)C#N)NC(=O)N2CCOCC2

Isomeric SMILES

CC(C)CC(C(=O)NC(CC(=O)OCC1=CC=CC=C1)C#N)NC(=O)N2CCOCC2

InChI

InChI=1S/C22H30N4O5/c1-16(2)12-19(25-22(29)26-8-10-30-11-9-26)21(28)24-18(14-23)13-20(27)31-15-17-6-4-3-5-7-17/h3-7,16,18-19H,8-13,15H2,1-2H3,(H,24,28)(H,25,29)