(3R)-3-ethyl-5-[[3-(hydroxymethyl)phenyl]amino]-3-methyl-5-oxidanylidene-pentanoic acid

Systemtic Name: (3R)-3-ethyl-5-[[3-(hydroxymethyl)phenyl]amino]-3-methyl-5-oxidanylidene-pentanoic acid Openeye Name: (3R)-3-ethyl-5-[3-(hydroxymethyl)anilino]-3-methyl-5-oxo-pentanoic acid CAS Name: (3R)-3-ethyl-5-[3-(hydroxymethyl)anilino]-3-methyl-5-oxopentanoic acid IUPAC Name: (3R)-3-ethyl-5-[3-(hydroxymethyl)anilino]-3-methyl-5-oxopentanoic acid Traditional Name: (3R)-3-ethyl-5-keto-3-methyl-5-(3-methylolanilino)valeric acid Formula: C15H21NO4 MolecularWeight: 279.33154

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CC(=O)NC1=CC=CC(=C1)CO)CC(=O)O

Isomeric SMILES

CC[C@](C)(CC(=O)NC1=CC=CC(=C1)CO)CC(=O)O

InChI

InChI=1S/C15H21NO4/c1-3-15(2,9-14(19)20)8-13(18)16-12-6-4-5-11(7-12)10-17/h4-7,17H,3,8-10H2,1-2H3,(H,16,18)(H,19,20)/t15-/m1/s1