[2-oxidanylidene-2-[[(2S)-2-phenylpropyl]amino]ethyl] 3-(3-oxidanylidene-1,4-benzoxazin-4-yl)propanoate

Systemtic Name: [2-oxidanylidene-2-[[(2S)-2-phenylpropyl]amino]ethyl] 3-(3-oxidanylidene-1,4-benzoxazin-4-yl)propanoate Openeye Name: [2-oxo-2-[[(2S)-2-phenylpropyl]amino]ethyl] 3-(3-oxo-1,4-benzoxazin-4-yl)propanoate CAS Name: 3-(3-oxo-1,4-benzoxazin-4-yl)propanoic acid [2-oxo-2-[[(2S)-2-phenylpropyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[(2S)-2-phenylpropyl]amino]ethyl] 3-(3-oxo-1,4-benzoxazin-4-yl)propanoate Traditional Name: 3-(3-keto-1,4-benzoxazin-4-yl)propionic acid [2-keto-2-[[(2S)-2-phenylpropyl]amino]ethyl] ester Formula: C22H24N2O5 MolecularWeight: 396.43636

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)COC(=O)CCN1C(=O)COC2=CC=CC=C21)C3=CC=CC=C3

Isomeric SMILES

C[C@H](CNC(=O)COC(=O)CCN1C(=O)COC2=CC=CC=C21)C3=CC=CC=C3

InChI

InChI=1S/C22H24N2O5/c1-16(17-7-3-2-4-8-17)13-23-20(25)14-29-22(27)11-12-24-18-9-5-6-10-19(18)28-15-21(24)26/h2-10,16H,11-15H2,1H3,(H,23,25)/t16-/m1/s1