tert-butyl (2S)-2-[(1-oxidanylidene-1-phenylmethoxy-propan-2-ylidene)amino]-5-phenyl-pentanoate

Systemtic Name: tert-butyl (2S)-2-[(1-oxidanylidene-1-phenylmethoxy-propan-2-ylidene)amino]-5-phenyl-pentanoate Openeye Name: tert-butyl (2S)-2-[(2-benzyloxy-1-methyl-2-oxo-ethylidene)amino]-5-phenyl-pentanoate CAS Name: (2S)-2-[(1-oxo-1-phenylmethoxypropan-2-ylidene)amino]-5-phenylpentanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[(1-oxo-1-phenylmethoxypropan-2-ylidene)amino]-5-phenylpentanoate Traditional Name: (2S)-2-[(2-benzoxy-2-keto-1-methyl-ethylidene)amino]-5-phenyl-valeric acid tert-butyl ester Formula: C25H31NO4 MolecularWeight: 409.51794

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NC(CCCC1=CC=CC=C1)C(=O)OC(C)(C)C)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(=N[C@@H](CCCC1=CC=CC=C1)C(=O)OC(C)(C)C)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C25H31NO4/c1-19(23(27)29-18-21-14-9-6-10-15-21)26-22(24(28)30-25(2,3)4)17-11-16-20-12-7-5-8-13-20/h5-10,12-15,22H,11,16-18H2,1-4H3/t22-/m0/s1