methyl (2S)-3-(2,4-dimethoxyphenyl)-2-[phenylmethoxycarbonyl-(phenylmethyl)amino]propanoate

Systemtic Name: methyl (2S)-3-(2,4-dimethoxyphenyl)-2-[phenylmethoxycarbonyl-(phenylmethyl)amino]propanoate Openeye Name: methyl (2S)-2-[benzyl(benzyloxycarbonyl)amino]-3-(2,4-dimethoxyphenyl)propanoate CAS Name: (2S)-3-(2,4-dimethoxyphenyl)-2-[phenylmethoxycarbonyl-(phenylmethyl)amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[benzyl(phenylmethoxycarbonyl)amino]-3-(2,4-dimethoxyphenyl)propanoate Traditional Name: (2S)-2-[benzyl(carbobenzoxy)amino]-3-(2,4-dimethoxyphenyl)propionic acid methyl ester Formula: C27H29NO6 MolecularWeight: 463.52226

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CC(C(=O)OC)N(CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C[C@@H](C(=O)OC)N(CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3)OC

InChI

InChI=1S/C27H29NO6/c1-31-23-15-14-22(25(17-23)32-2)16-24(26(29)33-3)28(18-20-10-6-4-7-11-20)27(30)34-19-21-12-8-5-9-13-21/h4-15,17,24H,16,18-19H2,1-3H3/t24-/m0/s1