1,3-bis(oxidanylidene)-2-[3-[(4-phenylmethoxyphenyl)carbamoyl]phenyl]isoindole-5-carboxylate

Systemtic Name: 1,3-bis(oxidanylidene)-2-[3-[(4-phenylmethoxyphenyl)carbamoyl]phenyl]isoindole-5-carboxylate Openeye Name: 2-[3-[(4-benzyloxyphenyl)carbamoyl]phenyl]-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 1,3-dioxo-2-[3-[oxo-(4-phenylmethoxyanilino)methyl]phenyl]-5-isoindolecarboxylate IUPAC Name: 1,3-dioxo-2-[3-[(4-phenylmethoxyphenyl)carbamoyl]phenyl]isoindole-5-carboxylate Traditional Name: 2-[3-[(4-benzoxyphenyl)carbamoyl]phenyl]-1,3-diketo-isoindoline-5-carboxylate Formula: C29H19N2O6- MolecularWeight: 491.47096

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)N4C(=O)C5=C(C4=O)C=C(C=C5)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)N4C(=O)C5=C(C4=O)C=C(C=C5)C(=O)[O-]

InChI

InChI=1S/C29H20N2O6/c32-26(30-21-10-12-23(13-11-21)37-17-18-5-2-1-3-6-18)19-7-4-8-22(15-19)31-27(33)24-14-9-20(29(35)36)16-25(24)28(31)34/h1-16H,17H2,(H,30,32)(H,35,36)/p-1