2,5-dimethyl-4-[methyl-(phenylmethyl)amino]-2-oxidanyl-3-oxidanylidene-heptanoic acid

Systemtic Name: 2,5-dimethyl-4-[methyl-(phenylmethyl)amino]-2-oxidanyl-3-oxidanylidene-heptanoic acid Openeye Name: 4-[benzyl(methyl)amino]-2-hydroxy-2,5-dimethyl-3-oxo-heptanoic acid CAS Name: 2-hydroxy-2,5-dimethyl-4-[methyl-(phenylmethyl)amino]-3-oxoheptanoic acid IUPAC Name: 4-[benzyl(methyl)amino]-2-hydroxy-2,5-dimethyl-3-oxoheptanoic acid Traditional Name: 4-[benzyl(methyl)amino]-2-hydroxy-3-keto-2,5-dimethyl-enanthic acid Formula: C17H25NO4 MolecularWeight: 307.3847

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)C(C)(C(=O)O)O)N(C)CC1=CC=CC=C1

Isomeric SMILES

CCC(C)C(C(=O)C(C)(C(=O)O)O)N(C)CC1=CC=CC=C1

InChI

InChI=1S/C17H25NO4/c1-5-12(2)14(15(19)17(3,22)16(20)21)18(4)11-13-9-7-6-8-10-13/h6-10,12,14,22H,5,11H2,1-4H3,(H,20,21)