[(2R,3R)-1-azanyl-3-(butanoylamino)-1-oxidanylidene-3-phenyl-propan-2-yl] butanoate

Systemtic Name: [(2R,3R)-1-azanyl-3-(butanoylamino)-1-oxidanylidene-3-phenyl-propan-2-yl] butanoate Openeye Name: [(1R)-2-amino-1-[(R)-(butanoylamino)-phenyl-methyl]-2-oxo-ethyl] butanoate CAS Name: butanoic acid [(2R,3R)-1-amino-1-oxo-3-(1-oxobutylamino)-3-phenylpropan-2-yl] ester IUPAC Name: [(2R,3R)-1-amino-3-(butanoylamino)-1-oxo-3-phenylpropan-2-yl] butanoate Traditional Name: butyric acid [(1R)-2-amino-1-[(R)-butyramido(phenyl)methyl]-2-keto-ethyl] ester Formula: C17H24N2O4 MolecularWeight: 320.38346

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC(C1=CC=CC=C1)C(C(=O)N)OC(=O)CCC

Isomeric SMILES

CCCC(=O)N[C@H](C1=CC=CC=C1)[C@H](C(=O)N)OC(=O)CCC

InChI

InChI=1S/C17H24N2O4/c1-3-8-13(20)19-15(12-10-6-5-7-11-12)16(17(18)22)23-14(21)9-4-2/h5-7,10-11,15-16H,3-4,8-9H2,1-2H3,(H2,18,22)(H,19,20)/t15-,16-/m1/s1