methyl (2S)-2-acetamido-3-[3-[5-[(2S)-2-acetamido-3-methoxy-3-oxidanylidene-propyl]-2-phenylmethoxy-phenyl]-4-phenylmethoxy-phenyl]propanoate

Systemtic Name: methyl (2S)-2-acetamido-3-[3-[5-[(2S)-2-acetamido-3-methoxy-3-oxidanylidene-propyl]-2-phenylmethoxy-phenyl]-4-phenylmethoxy-phenyl]propanoate Openeye Name: methyl (2S)-2-acetamido-3-[3-[5-[(2S)-2-acetamido-3-methoxy-3-oxo-propyl]-2-benzyloxy-phenyl]-4-benzyloxy-phenyl]propanoate CAS Name: (2S)-2-acetamido-3-[3-[5-[(2S)-2-acetamido-3-methoxy-3-oxopropyl]-2-phenylmethoxyphenyl]-4-phenylmethoxyphenyl]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-acetamido-3-[3-[5-[(2S)-2-acetamido-3-methoxy-3-oxopropyl]-2-phenylmethoxyphenyl]-4-phenylmethoxyphenyl]propanoate Traditional Name: (2S)-2-acetamido-3-[3-[5-[(2S)-2-acetamido-3-keto-3-methoxy-propyl]-2-benzoxy-phenyl]-4-benzoxy-phenyl]propionic acid methyl ester Formula: C38H40N2O8 MolecularWeight: 652.7328

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CC(=C(C=C1)OCC2=CC=CC=C2)C3=C(C=CC(=C3)CC(C(=O)OC)NC(=O)C)OCC4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC(=O)N[C@@H](CC1=CC(=C(C=C1)OCC2=CC=CC=C2)C3=C(C=CC(=C3)C[C@@H](C(=O)OC)NC(=O)C)OCC4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C38H40N2O8/c1-25(41)39-33(37(43)45-3)21-29-15-17-35(47-23-27-11-7-5-8-12-27)31(19-29)32-20-30(22-34(38(44)46-4)40-26(2)42)16-18-36(32)48-24-28-13-9-6-10-14-28/h5-20,33-34H,21-24H2,1-4H3,(H,39,41)(H,40,42)/t33-,34-/m0/s1