2-[carboxy-[2-(4-morpholin-4-ylcarbonylphenyl)ethyl]amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[carboxy-[2-(4-morpholin-4-ylcarbonylphenyl)ethyl]amino]-4-methyl-pentanoic acid Openeye Name: 2-[carboxy-[2-[4-(morpholine-4-carbonyl)phenyl]ethyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[carboxy-[2-[4-[4-morpholinyl(oxo)methyl]phenyl]ethyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[carboxy-[2-[4-(morpholine-4-carbonyl)phenyl]ethyl]amino]-4-methylpentanoic acid Traditional Name: 2-[carboxy-[2-[4-(morpholine-4-carbonyl)phenyl]ethyl]amino]-4-methyl-valeric acid Formula: C20H28N2O6 MolecularWeight: 392.44612

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)N(CCC1=CC=C(C=C1)C(=O)N2CCOCC2)C(=O)O

Isomeric SMILES

CC(C)CC(C(=O)O)N(CCC1=CC=C(C=C1)C(=O)N2CCOCC2)C(=O)O

InChI

InChI=1S/C20H28N2O6/c1-14(2)13-17(19(24)25)22(20(26)27)8-7-15-3-5-16(6-4-15)18(23)21-9-11-28-12-10-21/h3-6,14,17H,7-13H2,1-2H3,(H,24,25)(H,26,27)