methyl 4-[[1,3-bis(oxidanylidene)-2-phenethyl-isoindol-5-yl]carbonylamino]benzoate

Systemtic Name: methyl 4-[[1,3-bis(oxidanylidene)-2-phenethyl-isoindol-5-yl]carbonylamino]benzoate Openeye Name: methyl 4-[(1,3-dioxo-2-phenethyl-isoindoline-5-carbonyl)amino]benzoate CAS Name: 4-[[(1,3-dioxo-2-phenethyl-5-isoindolyl)-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(1,3-dioxo-2-phenethylisoindole-5-carbonyl)amino]benzoate Traditional Name: 4-[(1,3-diketo-2-phenethyl-isoindoline-5-carbonyl)amino]benzoic acid methyl ester Formula: C25H20N2O5 MolecularWeight: 428.4367

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CCC4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CCC4=CC=CC=C4

InChI

InChI=1S/C25H20N2O5/c1-32-25(31)17-7-10-19(11-8-17)26-22(28)18-9-12-20-21(15-18)24(30)27(23(20)29)14-13-16-5-3-2-4-6-16/h2-12,15H,13-14H2,1H3,(H,26,28)