ethyl 4-(3-pyridin-4-ylcarbonylimino-1H-isoindol-2-yl)benzoate

Systemtic Name: ethyl 4-(3-pyridin-4-ylcarbonylimino-1H-isoindol-2-yl)benzoate Openeye Name: ethyl 4-[1-(pyridine-4-carbonylimino)isoindolin-2-yl]benzoate CAS Name: 4-[3-[oxo(pyridin-4-yl)methyl]imino-1H-isoindol-2-yl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[3-(pyridine-4-carbonylimino)-1H-isoindol-2-yl]benzoate Traditional Name: 4-(1-isonicotinoyliminoisoindolin-2-yl)benzoic acid ethyl ester Formula: C23H19N3O3 MolecularWeight: 385.41526

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2CC3=CC=CC=C3C2=NC(=O)C4=CC=NC=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2CC3=CC=CC=C3C2=NC(=O)C4=CC=NC=C4

InChI

InChI=1S/C23H19N3O3/c1-2-29-23(28)17-7-9-19(10-8-17)26-15-18-5-3-4-6-20(18)21(26)25-22(27)16-11-13-24-14-12-16/h3-14H,2,15H2,1H3