2-(butanoylamino)-3-(hydroxymethyl)-2-methyl-4-oxidanylidene-4-(3-phenylpropylamino)butanoic acid

Systemtic Name: 2-(butanoylamino)-3-(hydroxymethyl)-2-methyl-4-oxidanylidene-4-(3-phenylpropylamino)butanoic acid Openeye Name: 2-(butanoylamino)-3-(hydroxymethyl)-2-methyl-4-oxo-4-(3-phenylpropylamino)butanoic acid CAS Name: 3-(hydroxymethyl)-2-methyl-4-oxo-2-(1-oxobutylamino)-4-(3-phenylpropylamino)butanoic acid IUPAC Name: 2-(butanoylamino)-3-(hydroxymethyl)-2-methyl-4-oxo-4-(3-phenylpropylamino)butanoic acid Traditional Name: 2-butyramido-4-keto-2-methyl-3-methylol-4-(3-phenylpropylamino)butyric acid Formula: C19H28N2O5 MolecularWeight: 364.43602

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC(C)(C(CO)C(=O)NCCCC1=CC=CC=C1)C(=O)O

Isomeric SMILES

CCCC(=O)NC(C)(C(CO)C(=O)NCCCC1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C19H28N2O5/c1-3-8-16(23)21-19(2,18(25)26)15(13-22)17(24)20-12-7-11-14-9-5-4-6-10-14/h4-6,9-10,15,22H,3,7-8,11-13H2,1-2H3,(H,20,24)(H,21,23)(H,25,26)