bis[2,3-bis(2-phenylpropan-2-yl)phenyl] 2-azanylpentanedioate

Systemtic Name: bis[2,3-bis(2-phenylpropan-2-yl)phenyl] 2-azanylpentanedioate Openeye Name: bis[2,3-bis(1-methyl-1-phenyl-ethyl)phenyl] 2-aminopentanedioate CAS Name: 2-aminopentanedioic acid bis[2,3-bis(2-phenylpropan-2-yl)phenyl] ester IUPAC Name: bis[2,3-bis(2-phenylpropan-2-yl)phenyl] 2-aminopentanedioate Traditional Name: 2-aminoglutaric acid bis(2,3-dicumylphenyl) ester Formula: C53H57NO4 MolecularWeight: 772.02398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1)C2=C(C(=CC=C2)OC(=O)CCC(C(=O)OC3=CC=CC(=C3C(C)(C)C4=CC=CC=C4)C(C)(C)C5=CC=CC=C5)N)C(C)(C)C6=CC=CC=C6

Isomeric SMILES

CC(C)(C1=CC=CC=C1)C2=C(C(=CC=C2)OC(=O)CCC(C(=O)OC3=CC=CC(=C3C(C)(C)C4=CC=CC=C4)C(C)(C)C5=CC=CC=C5)N)C(C)(C)C6=CC=CC=C6

InChI

InChI=1S/C53H57NO4/c1-50(2,37-23-13-9-14-24-37)41-31-21-33-44(47(41)52(5,6)39-27-17-11-18-28-39)57-46(55)36-35-43(54)49(56)58-45-34-22-32-42(51(3,4)38-25-15-10-16-26-38)48(45)53(7,8)40-29-19-12-20-30-40/h9-34,43H,35-36,54H2,1-8H3