methyl 3-[[3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-phenylmethoxy-phenyl]carbonylamino]propanoate

Systemtic Name: methyl 3-[[3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-phenylmethoxy-phenyl]carbonylamino]propanoate Openeye Name: methyl 3-[[4-benzyloxy-3-(tert-butoxycarbonylamino)benzoyl]amino]propanoate CAS Name: 3-[[[3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-phenylmethoxyphenyl]-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-[[3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-phenylmethoxybenzoyl]amino]propanoate Traditional Name: 3-[[4-benzoxy-3-(tert-butoxycarbonylamino)benzoyl]amino]propionic acid methyl ester Formula: C23H28N2O6 MolecularWeight: 428.47822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=C(C=CC(=C1)C(=O)NCCC(=O)OC)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)NC1=C(C=CC(=C1)C(=O)NCCC(=O)OC)OCC2=CC=CC=C2

InChI

InChI=1S/C23H28N2O6/c1-23(2,3)31-22(28)25-18-14-17(21(27)24-13-12-20(26)29-4)10-11-19(18)30-15-16-8-6-5-7-9-16/h5-11,14H,12-13,15H2,1-4H3,(H,24,27)(H,25,28)