5-[[2-(hydroxymethyl)phenyl]methyl]-4,7-bis(phenylmethyl)-1,3-diazepin-2-one

Systemtic Name: 5-[[2-(hydroxymethyl)phenyl]methyl]-4,7-bis(phenylmethyl)-1,3-diazepin-2-one Openeye Name: 4,7-dibenzyl-5-[[2-(hydroxymethyl)phenyl]methyl]-1,3-diazepin-2-one CAS Name: 5-[[2-(hydroxymethyl)phenyl]methyl]-4,7-bis(phenylmethyl)-1,3-diazepin-2-one IUPAC Name: 4,7-dibenzyl-5-[[2-(hydroxymethyl)phenyl]methyl]-1,3-diazepin-2-one Traditional Name: 4,7-dibenzyl-5-(2-methylolbenzyl)-1,3-diazepin-2-one Formula: C27H24N2O2 MolecularWeight: 408.49166

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NC(=O)N=C(C(=C2)CC3=CC=CC=C3CO)CC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CC2=NC(=O)N=C(C(=C2)CC3=CC=CC=C3CO)CC4=CC=CC=C4

InChI

InChI=1S/C27H24N2O2/c30-19-23-14-8-7-13-22(23)17-24-18-25(15-20-9-3-1-4-10-20)28-27(31)29-26(24)16-21-11-5-2-6-12-21/h1-14,18,30H,15-17,19H2