3-[1-[(E)-oct-5-en-3-yl]-4-oxidanylidene-quinolin-3-yl]-3-oxidanylidene-propanenitrile

Systemtic Name: 3-[1-[(E)-oct-5-en-3-yl]-4-oxidanylidene-quinolin-3-yl]-3-oxidanylidene-propanenitrile Openeye Name: 3-[1-[(E)-1-ethylhex-3-enyl]-4-oxo-3-quinolyl]-3-oxo-propanenitrile CAS Name: 3-[1-[(E)-oct-5-en-3-yl]-4-oxo-3-quinolinyl]-3-oxopropanenitrile IUPAC Name: 3-[1-[(E)-oct-5-en-3-yl]-4-oxoquinolin-3-yl]-3-oxopropanenitrile Traditional Name: 3-[1-[(E)-1-ethylhex-3-enyl]-4-keto-3-quinolyl]-3-keto-propionitrile Formula: C20H22N2O2 MolecularWeight: 322.40088

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CCC(CC)N1C=C(C(=O)C2=CC=CC=C21)C(=O)CC#N

Isomeric SMILES

CC/C=C/CC(CC)N1C=C(C(=O)C2=CC=CC=C21)C(=O)CC#N

InChI

InChI=1S/C20H22N2O2/c1-3-5-6-9-15(4-2)22-14-17(19(23)12-13-21)20(24)16-10-7-8-11-18(16)22/h5-8,10-11,14-15H,3-4,9,12H2,1-2H3/b6-5+