tert-butyl (2R)-4-methyl-2-[[2-oxidanyl-3-(phenylmethoxycarbonylamino)pentanoyl]amino]pentanoate

Systemtic Name: tert-butyl (2R)-4-methyl-2-[[2-oxidanyl-3-(phenylmethoxycarbonylamino)pentanoyl]amino]pentanoate Openeye Name: tert-butyl (2R)-2-[[3-(benzyloxycarbonylamino)-2-hydroxy-pentanoyl]amino]-4-methyl-pentanoate CAS Name: (2R)-2-[[2-hydroxy-1-oxo-3-(phenylmethoxycarbonylamino)pentyl]amino]-4-methylpentanoic acid tert-butyl ester IUPAC Name: tert-butyl (2R)-2-[[2-hydroxy-3-(phenylmethoxycarbonylamino)pentanoyl]amino]-4-methylpentanoate Traditional Name: (2R)-2-[[3-(benzyloxycarbonylamino)-2-hydroxy-pentanoyl]amino]-4-methyl-valeric acid tert-butyl ester Formula: C23H36N2O6 MolecularWeight: 436.54174

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C(=O)NC(CC(C)C)C(=O)OC(C)(C)C)O)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CCC(C(C(=O)N[C@H](CC(C)C)C(=O)OC(C)(C)C)O)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C23H36N2O6/c1-7-17(25-22(29)30-14-16-11-9-8-10-12-16)19(26)20(27)24-18(13-15(2)3)21(28)31-23(4,5)6/h8-12,15,17-19,26H,7,13-14H2,1-6H3,(H,24,27)(H,25,29)/t17?,18-,19?/m1/s1