methyl (2S)-2-[[3-(4-hydroxyphenyl)-2-(phenylmethoxycarbonylamino)propanoyl]amino]-4-methyl-pentanoate

Systemtic Name: methyl (2S)-2-[[3-(4-hydroxyphenyl)-2-(phenylmethoxycarbonylamino)propanoyl]amino]-4-methyl-pentanoate Openeye Name: methyl (2S)-2-[[2-(benzyloxycarbonylamino)-3-(4-hydroxyphenyl)propanoyl]amino]-4-methyl-pentanoate CAS Name: (2S)-2-[[3-(4-hydroxyphenyl)-1-oxo-2-(phenylmethoxycarbonylamino)propyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[3-(4-hydroxyphenyl)-2-(phenylmethoxycarbonylamino)propanoyl]amino]-4-methylpentanoate Traditional Name: (2S)-2-[[2-(benzyloxycarbonylamino)-3-(4-hydroxyphenyl)propanoyl]amino]-4-methyl-valeric acid methyl ester Formula: C24H30N2O6 MolecularWeight: 442.5048

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)C[C@@H](C(=O)OC)NC(=O)C(CC1=CC=C(C=C1)O)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C24H30N2O6/c1-16(2)13-21(23(29)31-3)25-22(28)20(14-17-9-11-19(27)12-10-17)26-24(30)32-15-18-7-5-4-6-8-18/h4-12,16,20-21,27H,13-15H2,1-3H3,(H,25,28)(H,26,30)/t20?,21-/m0/s1