[2-oxidanylidene-2-[[(2S)-pentan-2-yl]amino]ethyl] 2-benzamidoethanoate

Systemtic Name: [2-oxidanylidene-2-[[(2S)-pentan-2-yl]amino]ethyl] 2-benzamidoethanoate Openeye Name: [2-[[(1S)-1-methylbutyl]amino]-2-oxo-ethyl] 2-benzamidoacetate CAS Name: 2-benzamidoacetic acid [2-oxo-2-[[(2S)-pentan-2-yl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[(2S)-pentan-2-yl]amino]ethyl] 2-benzamidoacetate Traditional Name: 2-benzamidoacetic acid [2-keto-2-[[(1S)-1-methylbutyl]amino]ethyl] ester Formula: C16H22N2O4 MolecularWeight: 306.35688

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)COC(=O)CNC(=O)C1=CC=CC=C1

Isomeric SMILES

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

InChI

InChI=1S/C16H22N2O4/c1-3-7-12(2)18-14(19)11-22-15(20)10-17-16(21)13-8-5-4-6-9-13/h4-6,8-9,12H,3,7,10-11H2,1-2H3,(H,17,21)(H,18,19)/t12-/m0/s1