2-(3-azanylpropanoylamino)-3-methyl-N-(1-oxidanyl-2-oxidanylidene-5-phenyl-pentan-3-yl)pentanamide

Systemtic Name: 2-(3-azanylpropanoylamino)-3-methyl-N-(1-oxidanyl-2-oxidanylidene-5-phenyl-pentan-3-yl)pentanamide Openeye Name: 2-(3-aminopropanoylamino)-N-(3-hydroxy-2-oxo-1-phenethyl-propyl)-3-methyl-pentanamide CAS Name: 2-[(3-amino-1-oxopropyl)amino]-N-(1-hydroxy-2-oxo-5-phenylpentan-3-yl)-3-methylpentanamide IUPAC Name: 2-(3-aminopropanoylamino)-N-(1-hydroxy-2-oxo-5-phenylpentan-3-yl)-3-methylpentanamide Traditional Name: 2-(3-aminopropanoylamino)-N-(3-hydroxy-2-keto-1-phenethyl-propyl)-3-methyl-valeramide Formula: C20H31N3O4 MolecularWeight: 377.47784

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(CCC1=CC=CC=C1)C(=O)CO)NC(=O)CCN

Isomeric SMILES

CCC(C)C(C(=O)NC(CCC1=CC=CC=C1)C(=O)CO)NC(=O)CCN

InChI

InChI=1S/C20H31N3O4/c1-3-14(2)19(23-18(26)11-12-21)20(27)22-16(17(25)13-24)10-9-15-7-5-4-6-8-15/h4-8,14,16,19,24H,3,9-13,21H2,1-2H3,(H,22,27)(H,23,26)