2-azanyl-4-methyl-pentanoic acid; 2-(morpholin-4-ylcarbonylamino)-3-naphthalen-1-yl-propanoic acid

Systemtic Name: 2-azanyl-4-methyl-pentanoic acid; 2-(morpholin-4-ylcarbonylamino)-3-naphthalen-1-yl-propanoic acid Openeye Name: 2-amino-4-methyl-pentanoic acid; 2-(morpholine-4-carbonylamino)-3-(1-naphthyl)propanoic acid CAS Name: 2-amino-4-methylpentanoic acid; 2-[[4-morpholinyl(oxo)methyl]amino]-3-(1-naphthalenyl)propanoic acid IUPAC Name: 2-amino-4-methylpentanoic acid; 2-(morpholine-4-carbonylamino)-3-naphthalen-1-ylpropanoic acid Traditional Name: 2-amino-4-methyl-valeric acid; 2-(morpholine-4-carbonylamino)-3-(1-naphthyl)propionic acid Formula: C24H33N3O6 MolecularWeight: 459.53532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)N.C1COCCN1C(=O)NC(CC2=CC=CC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CC(C)CC(C(=O)O)N.C1COCCN1C(=O)NC(CC2=CC=CC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C18H20N2O4.C6H13NO2/c21-17(22)16(19-18(23)20-8-10-24-11-9-20)12-14-6-3-5-13-4-1-2-7-15(13)14;1-4(2)3-5(7)6(8)9/h1-7,16H,8-12H2,(H,19,23)(H,21,22);4-5H,3,7H2,1-2H3,(H,8,9)