2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 2-ethanoyl-3,4-dihydro-1H-isoquinoline-3-carboxylate

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 2-ethanoyl-3,4-dihydro-1H-isoquinoline-3-carboxylate Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl 2-acetyl-3,4-dihydro-1H-isoquinoline-3-carboxylate CAS Name: 2-acetyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl 2-acetyl-3,4-dihydro-1H-isoquinoline-3-carboxylate Traditional Name: 2-acetyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid 2-phthalimidoethyl ester Formula: C22H20N2O5 MolecularWeight: 392.4046

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC2=CC=CC=C2CC1C(=O)OCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC(=O)N1CC2=CC=CC=C2CC1C(=O)OCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C22H20N2O5/c1-14(25)24-13-16-7-3-2-6-15(16)12-19(24)22(28)29-11-10-23-20(26)17-8-4-5-9-18(17)21(23)27/h2-9,19H,10-13H2,1H3