[2-(phenylcarbonyloxymethyl)-1,3-dihydroperimidin-2-yl]methyl benzoate

Systemtic Name: [2-(phenylcarbonyloxymethyl)-1,3-dihydroperimidin-2-yl]methyl benzoate Openeye Name: [2-(benzoyloxymethyl)-1,3-dihydroperimidin-2-yl]methyl benzoate CAS Name: benzoic acid [2-(benzoyloxymethyl)-1,3-dihydroperimidin-2-yl]methyl ester IUPAC Name: [2-(benzoyloxymethyl)-1,3-dihydroperimidin-2-yl]methyl benzoate Traditional Name: benzoic acid [2-(benzoyloxymethyl)-1,3-dihydroperimidin-2-yl]methyl ester Formula: C27H22N2O4 MolecularWeight: 438.47458

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCC2(NC3=CC=CC4=C3C(=CC=C4)N2)COC(=O)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OCC2(NC3=CC=CC4=C3C(=CC=C4)N2)COC(=O)C5=CC=CC=C5

InChI

InChI=1S/C27H22N2O4/c30-25(20-9-3-1-4-10-20)32-17-27(18-33-26(31)21-11-5-2-6-12-21)28-22-15-7-13-19-14-8-16-23(29-27)24(19)22/h1-16,28-29H,17-18H2