2-(6-bromanyl-2,3-dihydro-1H-inden-1-yl)-2-(3-ethyl-2-oxidanylidene-1H-quinolin-7-yl)propanenitrile

Systemtic Name: 2-(6-bromanyl-2,3-dihydro-1H-inden-1-yl)-2-(3-ethyl-2-oxidanylidene-1H-quinolin-7-yl)propanenitrile Openeye Name: 2-(6-bromoindan-1-yl)-2-(3-ethyl-2-oxo-1H-quinolin-7-yl)propanenitrile CAS Name: 2-(6-bromo-2,3-dihydro-1H-inden-1-yl)-2-(3-ethyl-2-oxo-1H-quinolin-7-yl)propanenitrile IUPAC Name: 2-(6-bromo-2,3-dihydro-1H-inden-1-yl)-2-(3-ethyl-2-oxo-1H-quinolin-7-yl)propanenitrile Traditional Name: 2-(6-bromoindan-1-yl)-2-(3-ethyl-2-keto-1H-quinolin-7-yl)propionitrile Formula: C23H21BrN2O MolecularWeight: 421.32964

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C(C=C2)C(C)(C#N)C3CCC4=C3C=C(C=C4)Br)NC1=O

Isomeric SMILES

CCC1=CC2=C(C=C(C=C2)C(C)(C#N)C3CCC4=C3C=C(C=C4)Br)NC1=O

InChI

InChI=1S/C23H21BrN2O/c1-3-14-10-16-4-7-17(11-21(16)26-22(14)27)23(2,13-25)20-9-6-15-5-8-18(24)12-19(15)20/h4-5,7-8,10-12,20H,3,6,9H2,1-2H3,(H,26,27)