methyl (2S)-2-[(3,5-dimethoxyphenyl)methyl]-2-(phenylmethoxycarbonylamino)pent-4-enoate

Systemtic Name: methyl (2S)-2-[(3,5-dimethoxyphenyl)methyl]-2-(phenylmethoxycarbonylamino)pent-4-enoate Openeye Name: methyl (2S)-2-(benzyloxycarbonylamino)-2-[(3,5-dimethoxyphenyl)methyl]pent-4-enoate CAS Name: (2S)-2-[(3,5-dimethoxyphenyl)methyl]-2-(phenylmethoxycarbonylamino)-4-pentenoic acid methyl ester IUPAC Name: methyl (2S)-2-[(3,5-dimethoxyphenyl)methyl]-2-(phenylmethoxycarbonylamino)pent-4-enoate Traditional Name: (2S)-2-(benzyloxycarbonylamino)-2-(3,5-dimethoxybenzyl)pent-4-enoic acid methyl ester Formula: C23H27NO6 MolecularWeight: 413.46358

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CC(CC=C)(C(=O)OC)NC(=O)OCC2=CC=CC=C2)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C[C@@](CC=C)(C(=O)OC)NC(=O)OCC2=CC=CC=C2)OC

InChI

InChI=1S/C23H27NO6/c1-5-11-23(21(25)29-4,15-18-12-19(27-2)14-20(13-18)28-3)24-22(26)30-16-17-9-7-6-8-10-17/h5-10,12-14H,1,11,15-16H2,2-4H3,(H,24,26)/t23-/m0/s1