(phenylmethyl) 3-(1H-imidazol-5-ylmethyl)-2-(phenylmethyl)-4H-quinoxaline-1-carboxylate

Systemtic Name: (phenylmethyl) 3-(1H-imidazol-5-ylmethyl)-2-(phenylmethyl)-4H-quinoxaline-1-carboxylate Openeye Name: benzyl 2-benzyl-3-(1H-imidazol-5-ylmethyl)-4H-quinoxaline-1-carboxylate CAS Name: 3-(1H-imidazol-5-ylmethyl)-2-(phenylmethyl)-4H-quinoxaline-1-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-benzyl-3-(1H-imidazol-5-ylmethyl)-4H-quinoxaline-1-carboxylate Traditional Name: 2-benzyl-3-(1H-imidazol-5-ylmethyl)-4H-quinoxaline-1-carboxylic acid benzyl ester Formula: C27H24N4O2 MolecularWeight: 436.50506

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=C(NC3=CC=CC=C3N2C(=O)OCC4=CC=CC=C4)CC5=CN=CN5

Isomeric SMILES

C1=CC=C(C=C1)CC2=C(NC3=CC=CC=C3N2C(=O)OCC4=CC=CC=C4)CC5=CN=CN5

InChI

InChI=1S/C27H24N4O2/c32-27(33-18-21-11-5-2-6-12-21)31-25-14-8-7-13-23(25)30-24(16-22-17-28-19-29-22)26(31)15-20-9-3-1-4-10-20/h1-14,17,19,30H,15-16,18H2,(H,28,29)