[(1R)-1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl] (2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoate

Systemtic Name: [(1R)-1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl] (2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoate Openeye Name: [(1R)-1-(4-oxo-1H-quinazolin-2-yl)ethyl] (2S)-2-(benzyloxycarbonylamino)-3-methyl-butanoate CAS Name: (2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoic acid [(1R)-1-(4-oxo-1H-quinazolin-2-yl)ethyl] ester IUPAC Name: [(1R)-1-(4-oxo-1H-quinazolin-2-yl)ethyl] (2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoate Traditional Name: (2S)-2-(benzyloxycarbonylamino)-3-methyl-butyric acid [(1R)-1-(4-keto-1H-quinazolin-2-yl)ethyl] ester Formula: C23H25N3O5 MolecularWeight: 423.4617

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC(C)C1=NC(=O)C2=CC=CC=C2N1)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C[C@H](C1=NC(=O)C2=CC=CC=C2N1)OC(=O)[C@H](C(C)C)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C23H25N3O5/c1-14(2)19(25-23(29)30-13-16-9-5-4-6-10-16)22(28)31-15(3)20-24-18-12-8-7-11-17(18)21(27)26-20/h4-12,14-15,19H,13H2,1-3H3,(H,25,29)(H,24,26,27)/t15-,19+/m1/s1