6-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-2-(phenylmethoxycarbonylamino)hexanoic acid

Systemtic Name: 6-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-2-(phenylmethoxycarbonylamino)hexanoic acid Openeye Name: 2-(benzyloxycarbonylamino)-6-(5-methyl-2,4-dioxo-pyrimidin-1-yl)hexanoic acid CAS Name: 6-(5-methyl-2,4-dioxo-1-pyrimidinyl)-2-(phenylmethoxycarbonylamino)hexanoic acid IUPAC Name: 6-(5-methyl-2,4-dioxopyrimidin-1-yl)-2-(phenylmethoxycarbonylamino)hexanoic acid Traditional Name: 2-(benzyloxycarbonylamino)-6-(2,4-diketo-5-methyl-pyrimidin-1-yl)hexanoic acid Formula: C19H23N3O6 MolecularWeight: 389.40242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)NC1=O)CCCCC(C(=O)O)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC1=CN(C(=O)NC1=O)CCCCC(C(=O)O)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C19H23N3O6/c1-13-11-22(18(26)21-16(13)23)10-6-5-9-15(17(24)25)20-19(27)28-12-14-7-3-2-4-8-14/h2-4,7-8,11,15H,5-6,9-10,12H2,1H3,(H,20,27)(H,24,25)(H,21,23,26)