ethyl (2S)-3-(2,4-diethoxyphenyl)-2-[phenylmethoxycarbonyl-(phenylmethyl)amino]propanoate

Systemtic Name: ethyl (2S)-3-(2,4-diethoxyphenyl)-2-[phenylmethoxycarbonyl-(phenylmethyl)amino]propanoate Openeye Name: ethyl (2S)-2-[benzyl(benzyloxycarbonyl)amino]-3-(2,4-diethoxyphenyl)propanoate CAS Name: (2S)-3-(2,4-diethoxyphenyl)-2-[phenylmethoxycarbonyl-(phenylmethyl)amino]propanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-[benzyl(phenylmethoxycarbonyl)amino]-3-(2,4-diethoxyphenyl)propanoate Traditional Name: (2S)-2-[benzyl(carbobenzoxy)amino]-3-(2,4-diethoxyphenyl)propionic acid ethyl ester Formula: C30H35NO6 MolecularWeight: 505.602

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)CC(C(=O)OCC)N(CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3)OCC

Isomeric SMILES

CCOC1=CC(=C(C=C1)C[C@@H](C(=O)OCC)N(CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3)OCC

InChI

InChI=1S/C30H35NO6/c1-4-34-26-18-17-25(28(20-26)35-5-2)19-27(29(32)36-6-3)31(21-23-13-9-7-10-14-23)30(33)37-22-24-15-11-8-12-16-24/h7-18,20,27H,4-6,19,21-22H2,1-3H3/t27-/m0/s1