methyl (2S)-2-[[2-(phenylcarbamoyl)phenyl]amino]-3-(4-phenylmethoxyphenyl)propanoate

Systemtic Name: methyl (2S)-2-[[2-(phenylcarbamoyl)phenyl]amino]-3-(4-phenylmethoxyphenyl)propanoate Openeye Name: methyl (2S)-3-(4-benzyloxyphenyl)-2-[2-(phenylcarbamoyl)anilino]propanoate CAS Name: (2S)-2-[2-[anilino(oxo)methyl]anilino]-3-(4-phenylmethoxyphenyl)propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[2-(phenylcarbamoyl)anilino]-3-(4-phenylmethoxyphenyl)propanoate Traditional Name: (2S)-3-(4-benzoxyphenyl)-2-[2-(phenylcarbamoyl)anilino]propionic acid methyl ester Formula: C30H28N2O4 MolecularWeight: 480.55432

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=C(C=C1)OCC2=CC=CC=C2)NC3=CC=CC=C3C(=O)NC4=CC=CC=C4

Isomeric SMILES

COC(=O)[C@H](CC1=CC=C(C=C1)OCC2=CC=CC=C2)NC3=CC=CC=C3C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C30H28N2O4/c1-35-30(34)28(20-22-16-18-25(19-17-22)36-21-23-10-4-2-5-11-23)32-27-15-9-8-14-26(27)29(33)31-24-12-6-3-7-13-24/h2-19,28,32H,20-21H2,1H3,(H,31,33)/t28-/m0/s1