O1-(3-imidazol-1-ylpropyl) O4-(phenylmethyl) butanedioate

Systemtic Name: O1-(3-imidazol-1-ylpropyl) O4-(phenylmethyl) butanedioate Openeye Name: O4-benzyl O1-(3-imidazol-1-ylpropyl) butanedioate CAS Name: butanedioic acid O1-[3-(1-imidazolyl)propyl] ester O4-(phenylmethyl) ester IUPAC Name: 4-O-benzyl 1-O-(3-imidazol-1-ylpropyl) butanedioate Traditional Name: succinic acid O4-benzyl ester O1-(3-imidazol-1-ylpropyl) ester Formula: C17H20N2O4 MolecularWeight: 316.3517

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CCC(=O)OCCCN2C=CN=C2

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CCC(=O)OCCCN2C=CN=C2

InChI

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