O6-(2-imidazol-1-yl-1-phenyl-ethyl) O1-(phenylmethyl) hexanedioate

Systemtic Name: O6-(2-imidazol-1-yl-1-phenyl-ethyl) O1-(phenylmethyl) hexanedioate Openeye Name: O1-benzyl O6-(2-imidazol-1-yl-1-phenyl-ethyl) hexanedioate CAS Name: hexanedioic acid O6-[2-(1-imidazolyl)-1-phenylethyl] ester O1-(phenylmethyl) ester IUPAC Name: 1-O-benzyl 6-O-(2-imidazol-1-yl-1-phenylethyl) hexanedioate Traditional Name: adipic acid O1-benzyl ester O6-(2-imidazol-1-yl-1-phenyl-ethyl) ester Formula: C24H26N2O4 MolecularWeight: 406.47424

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CCCCC(=O)OC(CN2C=CN=C2)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CCCCC(=O)OC(CN2C=CN=C2)C3=CC=CC=C3

InChI

InChI=1S/C24H26N2O4/c27-23(29-18-20-9-3-1-4-10-20)13-7-8-14-24(28)30-22(17-26-16-15-25-19-26)21-11-5-2-6-12-21/h1-6,9-12,15-16,19,22H,7-8,13-14,17-18H2