(2R,3R)-3-(4-methylphenyl)-4-(2-methylpropyl)-5-oxidanylidene-morpholine-2-carboxylic acid

Systemtic Name: (2R,3R)-3-(4-methylphenyl)-4-(2-methylpropyl)-5-oxidanylidene-morpholine-2-carboxylic acid Openeye Name: (2R,3R)-4-isobutyl-5-oxo-3-(p-tolyl)morpholine-2-carboxylic acid CAS Name: (2R,3R)-3-(4-methylphenyl)-4-(2-methylpropyl)-5-oxo-2-morpholinecarboxylic acid IUPAC Name: (2R,3R)-3-(4-methylphenyl)-4-(2-methylpropyl)-5-oxomorpholine-2-carboxylic acid Traditional Name: (2R,3R)-4-isobutyl-5-keto-3-(p-tolyl)morpholine-2-carboxylic acid Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(OCC(=O)N2CC(C)C)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)[C@@H]2[C@@H](OCC(=O)N2CC(C)C)C(=O)O

InChI

InChI=1S/C16H21NO4/c1-10(2)8-17-13(18)9-21-15(16(19)20)14(17)12-6-4-11(3)5-7-12/h4-7,10,14-15H,8-9H2,1-3H3,(H,19,20)/t14-,15-/m1/s1