ethyl (5S)-6-methyl-4-oxidanylidene-5-(phenylmethoxycarbonylamino)-2-(phenylmethyl)heptanoate

Systemtic Name: ethyl (5S)-6-methyl-4-oxidanylidene-5-(phenylmethoxycarbonylamino)-2-(phenylmethyl)heptanoate Openeye Name: ethyl (5S)-2-benzyl-5-(benzyloxycarbonylamino)-6-methyl-4-oxo-heptanoate CAS Name: (5S)-6-methyl-4-oxo-5-(phenylmethoxycarbonylamino)-2-(phenylmethyl)heptanoic acid ethyl ester IUPAC Name: ethyl (5S)-2-benzyl-6-methyl-4-oxo-5-(phenylmethoxycarbonylamino)heptanoate Traditional Name: (5S)-2-benzyl-5-(benzyloxycarbonylamino)-4-keto-6-methyl-enanthic acid ethyl ester Formula: C25H31NO5 MolecularWeight: 425.51734

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=CC=C1)CC(=O)C(C(C)C)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C(CC1=CC=CC=C1)CC(=O)[C@H](C(C)C)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C25H31NO5/c1-4-30-24(28)21(15-19-11-7-5-8-12-19)16-22(27)23(18(2)3)26-25(29)31-17-20-13-9-6-10-14-20/h5-14,18,21,23H,4,15-17H2,1-3H3,(H,26,29)/t21?,23-/m0/s1