2-methylpropoxycarbonyl 6-acetamido-2-(phenylmethoxycarbonylamino)hexanoate

Systemtic Name: 2-methylpropoxycarbonyl 6-acetamido-2-(phenylmethoxycarbonylamino)hexanoate Openeye Name: isobutoxycarbonyl 6-acetamido-2-(benzyloxycarbonylamino)hexanoate CAS Name: 6-acetamido-2-(phenylmethoxycarbonylamino)hexanoic acid [2-methylpropoxy(oxo)methyl] ester IUPAC Name: 2-methylpropoxycarbonyl 6-acetamido-2-(phenylmethoxycarbonylamino)hexanoate Traditional Name: 6-acetamido-2-(benzyloxycarbonylamino)hexanoic acid isobutoxycarbonyl ester Formula: C21H30N2O7 MolecularWeight: 422.4721

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)OC(=O)C(CCCCNC(=O)C)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC(C)COC(=O)OC(=O)C(CCCCNC(=O)C)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C21H30N2O7/c1-15(2)13-29-21(27)30-19(25)18(11-7-8-12-22-16(3)24)23-20(26)28-14-17-9-5-4-6-10-17/h4-6,9-10,15,18H,7-8,11-14H2,1-3H3,(H,22,24)(H,23,26)