(phenylmethyl) 3-(4-methoxyphenyl)-2-[[3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]propanoate

Systemtic Name: (phenylmethyl) 3-(4-methoxyphenyl)-2-[[3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]propanoate Openeye Name: benzyl 2-[[2-(benzyloxycarbonylamino)-3-methyl-butanoyl]amino]-3-(4-methoxyphenyl)propanoate CAS Name: 3-(4-methoxyphenyl)-2-[[3-methyl-1-oxo-2-(phenylmethoxycarbonylamino)butyl]amino]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-(4-methoxyphenyl)-2-[[3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]propanoate Traditional Name: 2-[[2-(benzyloxycarbonylamino)-3-methyl-butanoyl]amino]-3-(4-methoxyphenyl)propionic acid benzyl ester Formula: C30H34N2O6 MolecularWeight: 518.60076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(CC1=CC=C(C=C1)OC)C(=O)OCC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)C(C(=O)NC(CC1=CC=C(C=C1)OC)C(=O)OCC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C30H34N2O6/c1-21(2)27(32-30(35)38-20-24-12-8-5-9-13-24)28(33)31-26(18-22-14-16-25(36-3)17-15-22)29(34)37-19-23-10-6-4-7-11-23/h4-17,21,26-27H,18-20H2,1-3H3,(H,31,33)(H,32,35)