O1-methyl O7-(phenylmethyl) 2,5-bis(azanyl)-2-methyl-4-oxidanylidene-3-phenyl-heptanedioate

Systemtic Name: O1-methyl O7-(phenylmethyl) 2,5-bis(azanyl)-2-methyl-4-oxidanylidene-3-phenyl-heptanedioate Openeye Name: O7-benzyl O1-methyl 2,5-diamino-2-methyl-4-oxo-3-phenyl-heptanedioate CAS Name: 2,5-diamino-2-methyl-4-oxo-3-phenylheptanedioic acid O1-methyl ester O7-(phenylmethyl) ester IUPAC Name: 7-O-benzyl 1-O-methyl 2,5-diamino-2-methyl-4-oxo-3-phenylheptanedioate Traditional Name: 2,5-diamino-4-keto-2-methyl-3-phenyl-pimelic acid O7-benzyl ester O1-methyl ester Formula: C22H26N2O5 MolecularWeight: 398.45224

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CC=C1)C(=O)C(CC(=O)OCC2=CC=CC=C2)N)(C(=O)OC)N

Isomeric SMILES

CC(C(C1=CC=CC=C1)C(=O)C(CC(=O)OCC2=CC=CC=C2)N)(C(=O)OC)N

InChI

InChI=1S/C22H26N2O5/c1-22(24,21(27)28-2)19(16-11-7-4-8-12-16)20(26)17(23)13-18(25)29-14-15-9-5-3-6-10-15/h3-12,17,19H,13-14,23-24H2,1-2H3