N-cyclooctyl-2-[(4-ethoxyphenyl)methyl]-3-oxidanylidene-1H-isoindole-1-carboxamide

Systemtic Name: N-cyclooctyl-2-[(4-ethoxyphenyl)methyl]-3-oxidanylidene-1H-isoindole-1-carboxamide Openeye Name: N-cyclooctyl-2-[(4-ethoxyphenyl)methyl]-3-oxo-isoindoline-1-carboxamide CAS Name: N-cyclooctyl-2-[(4-ethoxyphenyl)methyl]-3-oxo-1H-isoindole-1-carboxamide IUPAC Name: N-cyclooctyl-2-[(4-ethoxyphenyl)methyl]-3-oxo-1H-isoindole-1-carboxamide Traditional Name: N-cyclooctyl-2-(4-ethoxybenzyl)-3-keto-isoindoline-1-carboxamide Formula: C26H32N2O3 MolecularWeight: 420.54388

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CN2C(C3=CC=CC=C3C2=O)C(=O)NC4CCCCCCC4

Isomeric SMILES

CCOC1=CC=C(C=C1)CN2C(C3=CC=CC=C3C2=O)C(=O)NC4CCCCCCC4

InChI

InChI=1S/C26H32N2O3/c1-2-31-21-16-14-19(15-17-21)18-28-24(22-12-8-9-13-23(22)26(28)30)25(29)27-20-10-6-4-3-5-7-11-20/h8-9,12-17,20,24H,2-7,10-11,18H2,1H3,(H,27,29)