[2-oxidanylidene-2-(pentan-3-ylamino)ethyl] (2S)-2-(phenylcarbamoylamino)propanoate

Systemtic Name: [2-oxidanylidene-2-(pentan-3-ylamino)ethyl] (2S)-2-(phenylcarbamoylamino)propanoate Openeye Name: [2-(1-ethylpropylamino)-2-oxo-ethyl] (2S)-2-(phenylcarbamoylamino)propanoate CAS Name: (2S)-2-[[anilino(oxo)methyl]amino]propanoic acid [2-oxo-2-(pentan-3-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-3-ylamino)ethyl] (2S)-2-(phenylcarbamoylamino)propanoate Traditional Name: (2S)-2-(phenylcarbamoylamino)propionic acid [2-(1-ethylpropylamino)-2-keto-ethyl] ester Formula: C17H25N3O4 MolecularWeight: 335.3981

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)COC(=O)C(C)NC(=O)NC1=CC=CC=C1

Isomeric SMILES

CCC(CC)NC(=O)COC(=O)[C@H](C)NC(=O)NC1=CC=CC=C1

InChI

InChI=1S/C17H25N3O4/c1-4-13(5-2)19-15(21)11-24-16(22)12(3)18-17(23)20-14-9-7-6-8-10-14/h6-10,12-13H,4-5,11H2,1-3H3,(H,19,21)(H2,18,20,23)/t12-/m0/s1