methyl 2-[3-[3-azanylidene-6-ethoxy-5-(methylcarbamoyl)-1H-isoindol-2-yl]-2-ethanoyl-phenyl]-2-methyl-propanoate

Systemtic Name: methyl 2-[3-[3-azanylidene-6-ethoxy-5-(methylcarbamoyl)-1H-isoindol-2-yl]-2-ethanoyl-phenyl]-2-methyl-propanoate Openeye Name: methyl 2-[2-acetyl-3-[5-ethoxy-1-imino-6-(methylcarbamoyl)isoindolin-2-yl]phenyl]-2-methyl-propanoate CAS Name: 2-[2-acetyl-3-[6-ethoxy-3-imino-5-(methylcarbamoyl)-1H-isoindol-2-yl]phenyl]-2-methylpropanoic acid methyl ester IUPAC Name: methyl 2-[2-acetyl-3-[6-ethoxy-3-imino-5-(methylcarbamoyl)-1H-isoindol-2-yl]phenyl]-2-methylpropanoate Traditional Name: 2-[2-acetyl-3-[5-ethoxy-1-imino-6-(methylcarbamoyl)isoindolin-2-yl]phenyl]-2-methyl-propionic acid methyl ester Formula: C25H29N3O5 MolecularWeight: 451.51486

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CN(C2=N)C3=CC=CC(=C3C(=O)C)C(C)(C)C(=O)OC)C(=O)NC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)CN(C2=N)C3=CC=CC(=C3C(=O)C)C(C)(C)C(=O)OC)C(=O)NC

InChI

InChI=1S/C25H29N3O5/c1-7-33-20-11-15-13-28(22(26)16(15)12-17(20)23(30)27-5)19-10-8-9-18(21(19)14(2)29)25(3,4)24(31)32-6/h8-12,26H,7,13H2,1-6H3,(H,27,30)