(1-methoxy-4-methyl-1-oxidanylidene-pentan-2-yl) 4-methyl-2-(phenylmethoxycarbonylamino)pentanoate

Systemtic Name: (1-methoxy-4-methyl-1-oxidanylidene-pentan-2-yl) 4-methyl-2-(phenylmethoxycarbonylamino)pentanoate Openeye Name: (1-methoxycarbonyl-3-methyl-butyl) 2-(benzyloxycarbonylamino)-4-methyl-pentanoate CAS Name: 4-methyl-2-(phenylmethoxycarbonylamino)pentanoic acid (1-methoxy-4-methyl-1-oxopentan-2-yl) ester IUPAC Name: (1-methoxy-4-methyl-1-oxopentan-2-yl) 4-methyl-2-(phenylmethoxycarbonylamino)pentanoate Traditional Name: 2-(benzyloxycarbonylamino)-4-methyl-valeric acid (1-carbomethoxy-3-methyl-butyl) ester Formula: C21H31NO6 MolecularWeight: 393.47394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H31NO6/c1-14(2)11-17(19(23)28-18(12-15(3)4)20(24)26-5)22-21(25)27-13-16-9-7-6-8-10-16/h6-10,14-15,17-18H,11-13H2,1-5H3,(H,22,25)