methyl 5-[[(2S)-2-acetamido-3-(4-phenylmethoxyphenyl)propanoyl]amino]-4-oxidanylidene-pentanoate

Systemtic Name: methyl 5-[[(2S)-2-acetamido-3-(4-phenylmethoxyphenyl)propanoyl]amino]-4-oxidanylidene-pentanoate Openeye Name: methyl 5-[[(2S)-2-acetamido-3-(4-benzyloxyphenyl)propanoyl]amino]-4-oxo-pentanoate CAS Name: 5-[[(2S)-2-acetamido-1-oxo-3-(4-phenylmethoxyphenyl)propyl]amino]-4-oxopentanoic acid methyl ester IUPAC Name: methyl 5-[[(2S)-2-acetamido-3-(4-phenylmethoxyphenyl)propanoyl]amino]-4-oxopentanoate Traditional Name: 5-[[(2S)-2-acetamido-3-(4-benzoxyphenyl)propanoyl]amino]-4-keto-valeric acid methyl ester Formula: C24H28N2O6 MolecularWeight: 440.48892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)NCC(=O)CCC(=O)OC

Isomeric SMILES

CC(=O)N[C@@H](CC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)NCC(=O)CCC(=O)OC

InChI

InChI=1S/C24H28N2O6/c1-17(27)26-22(24(30)25-15-20(28)10-13-23(29)31-2)14-18-8-11-21(12-9-18)32-16-19-6-4-3-5-7-19/h3-9,11-12,22H,10,13-16H2,1-2H3,(H,25,30)(H,26,27)/t22-/m0/s1