methyl (2S)-2-[[5-oxidanylidene-5-[(4-phenylmethoxyphenyl)amino]pentanoyl]amino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[[5-oxidanylidene-5-[(4-phenylmethoxyphenyl)amino]pentanoyl]amino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[[5-(4-benzyloxyanilino)-5-oxo-pentanoyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[1,5-dioxo-5-(4-phenylmethoxyanilino)pentyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[5-oxo-5-(4-phenylmethoxyanilino)pentanoyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[5-(4-benzoxyanilino)-5-keto-pentanoyl]amino]-3-phenyl-propionic acid methyl ester Formula: C28H30N2O5 MolecularWeight: 474.5482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)CCCC(=O)NC2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CCCC(=O)NC2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C28H30N2O5/c1-34-28(33)25(19-21-9-4-2-5-10-21)30-27(32)14-8-13-26(31)29-23-15-17-24(18-16-23)35-20-22-11-6-3-7-12-22/h2-7,9-12,15-18,25H,8,13-14,19-20H2,1H3,(H,29,31)(H,30,32)/t25-/m0/s1