phenyl 2-[3-azanylidene-6-ethoxy-5-(methylcarbamoyl)-1H-isoindol-2-yl]-2-ethanoyl-3,3-dimethyl-butanoate

Systemtic Name: phenyl 2-[3-azanylidene-6-ethoxy-5-(methylcarbamoyl)-1H-isoindol-2-yl]-2-ethanoyl-3,3-dimethyl-butanoate Openeye Name: phenyl 2-acetyl-2-[5-ethoxy-1-imino-6-(methylcarbamoyl)isoindolin-2-yl]-3,3-dimethyl-butanoate CAS Name: 2-acetyl-2-[6-ethoxy-3-imino-5-(methylcarbamoyl)-1H-isoindol-2-yl]-3,3-dimethylbutanoic acid phenyl ester IUPAC Name: phenyl 2-acetyl-2-[6-ethoxy-3-imino-5-(methylcarbamoyl)-1H-isoindol-2-yl]-3,3-dimethylbutanoate Traditional Name: 2-acetyl-2-[5-ethoxy-1-imino-6-(methylcarbamoyl)isoindolin-2-yl]-3,3-dimethyl-butyric acid phenyl ester Formula: C26H31N3O5 MolecularWeight: 465.54144

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CN(C2=N)C(C(=O)C)(C(=O)OC3=CC=CC=C3)C(C)(C)C)C(=O)NC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)CN(C2=N)C(C(=O)C)(C(=O)OC3=CC=CC=C3)C(C)(C)C)C(=O)NC

InChI

InChI=1S/C26H31N3O5/c1-7-33-21-13-17-15-29(22(27)19(17)14-20(21)23(31)28-6)26(16(2)30,25(3,4)5)24(32)34-18-11-9-8-10-12-18/h8-14,27H,7,15H2,1-6H3,(H,28,31)