ethyl N-(2-cyanopyridin-4-yl)carbonyl-5,7-dihydrobenzo[d][2]benzazepine-6-carboximidate

Systemtic Name: ethyl N-(2-cyanopyridin-4-yl)carbonyl-5,7-dihydrobenzo[d][2]benzazepine-6-carboximidate Openeye Name: ethyl N-(2-cyanopyridine-4-carbonyl)-5,7-dihydrobenzo[d][2]benzazepine-6-carboximidate CAS Name: N-[(2-cyano-4-pyridinyl)-oxomethyl]-5,7-dihydrobenzo[d][2]benzazepine-6-carboximidic acid ethyl ester IUPAC Name: ethyl N-(2-cyanopyridine-4-carbonyl)-5,7-dihydrobenzo[d][2]benzazepine-6-carboximidate Traditional Name: N-(2-cyanoisonicotinoyl)-5,7-dihydrobenzo[d][2]benzazepine-6-carboximidic acid ethyl ester Formula: C24H20N4O2 MolecularWeight: 396.4412

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=NC(=O)C1=CC(=NC=C1)C#N)N2CC3=CC=CC=C3C4=CC=CC=C4C2

Isomeric SMILES

CCOC(=NC(=O)C1=CC(=NC=C1)C#N)N2CC3=CC=CC=C3C4=CC=CC=C4C2

InChI

InChI=1S/C24H20N4O2/c1-2-30-24(27-23(29)17-11-12-26-20(13-17)14-25)28-15-18-7-3-5-9-21(18)22-10-6-4-8-19(22)16-28/h3-13H,2,15-16H2,1H3