2-azanylpentanoic acid; methyl 2-(morpholin-4-ylcarbonylamino)-3-phenyl-propanoate

Systemtic Name: 2-azanylpentanoic acid; methyl 2-(morpholin-4-ylcarbonylamino)-3-phenyl-propanoate Openeye Name: 2-aminopentanoic acid; methyl 2-(morpholine-4-carbonylamino)-3-phenyl-propanoate CAS Name: 2-aminopentanoic acid; 2-[[4-morpholinyl(oxo)methyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: 2-aminopentanoic acid; methyl 2-(morpholine-4-carbonylamino)-3-phenylpropanoate Traditional Name: 2-aminovaleric acid; 2-(morpholine-4-carbonylamino)-3-phenyl-propionic acid methyl ester Formula: C20H31N3O6 MolecularWeight: 409.47664

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)O)N.COC(=O)C(CC1=CC=CC=C1)NC(=O)N2CCOCC2

Isomeric SMILES

CCCC(C(=O)O)N.COC(=O)C(CC1=CC=CC=C1)NC(=O)N2CCOCC2

InChI

InChI=1S/C15H20N2O4.C5H11NO2/c1-20-14(18)13(11-12-5-3-2-4-6-12)16-15(19)17-7-9-21-10-8-17;1-2-3-4(6)5(7)8/h2-6,13H,7-11H2,1H3,(H,16,19);4H,2-3,6H2,1H3,(H,7,8)