2-cyanoethyl (4S)-2-methyl-5-oxidanylidene-4-pyridin-3-yl-3,4-dihydroindeno[1,2-b]pyridine-3-carboxylate

Systemtic Name: 2-cyanoethyl (4S)-2-methyl-5-oxidanylidene-4-pyridin-3-yl-3,4-dihydroindeno[1,2-b]pyridine-3-carboxylate Openeye Name: 2-cyanoethyl (4S)-2-methyl-5-oxo-4-(3-pyridyl)-3,4-dihydroindeno[1,2-b]pyridine-3-carboxylate CAS Name: (4S)-2-methyl-5-oxo-4-(3-pyridinyl)-3,4-dihydroindeno[1,2-b]pyridine-3-carboxylic acid 2-cyanoethyl ester IUPAC Name: 2-cyanoethyl (4S)-2-methyl-5-oxo-4-pyridin-3-yl-3,4-dihydroindeno[1,2-b]pyridine-3-carboxylate Traditional Name: (4S)-5-keto-2-methyl-4-(3-pyridyl)-3,4-dihydroindeno[1,2-b]pyridine-3-carboxylic acid 2-cyanoethyl ester Formula: C22H17N3O3 MolecularWeight: 371.38868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(C1C(=O)OCCC#N)C3=CN=CC=C3)C(=O)C4=CC=CC=C42

Isomeric SMILES

CC1=NC2=C([C@@H](C1C(=O)OCCC#N)C3=CN=CC=C3)C(=O)C4=CC=CC=C42

InChI

InChI=1S/C22H17N3O3/c1-13-17(22(27)28-11-5-9-23)18(14-6-4-10-24-12-14)19-20(25-13)15-7-2-3-8-16(15)21(19)26/h2-4,6-8,10,12,17-18H,5,11H2,1H3/t17?,18-/m1/s1