O6-(imidazol-1-ylmethyl) O1-(phenylmethyl) hexanedioate

Systemtic Name: O6-(imidazol-1-ylmethyl) O1-(phenylmethyl) hexanedioate Openeye Name: O1-benzyl O6-(imidazol-1-ylmethyl) hexanedioate CAS Name: hexanedioic acid O6-(1-imidazolylmethyl) ester O1-(phenylmethyl) ester IUPAC Name: 1-O-benzyl 6-O-(imidazol-1-ylmethyl) hexanedioate Traditional Name: adipic acid O1-benzyl ester O6-(imidazol-1-ylmethyl) ester Formula: C17H20N2O4 MolecularWeight: 316.3517

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CCCCC(=O)OCN2C=CN=C2

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CCCCC(=O)OCN2C=CN=C2

InChI

InChI=1S/C17H20N2O4/c20-16(22-12-15-6-2-1-3-7-15)8-4-5-9-17(21)23-14-19-11-10-18-13-19/h1-3,6-7,10-11,13H,4-5,8-9,12,14H2