[2-(1H-pyrrol-2-yl)phenyl] 2-[(2-aminophenyl)methyl]-3-phenyl-propaneperoxoate

Systemtic Name: [2-(1H-pyrrol-2-yl)phenyl] 2-[(2-aminophenyl)methyl]-3-phenyl-propaneperoxoate Openeye Name: [2-(1H-pyrrol-2-yl)phenyl] 2-[(2-aminophenyl)methyl]-3-phenyl-propaneperoxoate CAS Name: 2-[(2-aminophenyl)methyl]-3-phenylpropaneperoxoic acid [2-(1H-pyrrol-2-yl)phenyl] ester IUPAC Name: [2-(1H-pyrrol-2-yl)phenyl] 2-[(2-aminophenyl)methyl]-3-phenylpropaneperoxoate Traditional Name: 2-(2-aminobenzyl)-3-phenyl-peroxypropionic acid [2-(1H-pyrrol-2-yl)phenyl] ester Formula: C26H24N2O3 MolecularWeight: 412.48036

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CC2=CC=CC=C2N)C(=O)OOC3=CC=CC=C3C4=CC=CN4

Isomeric SMILES

C1=CC=C(C=C1)CC(CC2=CC=CC=C2N)C(=O)OOC3=CC=CC=C3C4=CC=CN4

InChI

InChI=1S/C26H24N2O3/c27-23-13-6-4-11-20(23)18-21(17-19-9-2-1-3-10-19)26(29)31-30-25-15-7-5-12-22(25)24-14-8-16-28-24/h1-16,21,28H,17-18,27H2