7-cyano-7-(4-methoxyphenyl)-7-quinolin-2-yl-heptanoate

Systemtic Name: 7-cyano-7-(4-methoxyphenyl)-7-quinolin-2-yl-heptanoate Openeye Name: 7-cyano-7-(4-methoxyphenyl)-7-(2-quinolyl)heptanoate CAS Name: 7-cyano-7-(4-methoxyphenyl)-7-(2-quinolinyl)heptanoate IUPAC Name: 7-cyano-7-(4-methoxyphenyl)-7-quinolin-2-ylheptanoate Traditional Name: 7-cyano-7-(4-methoxyphenyl)-7-(2-quinolyl)enanthate Formula: C24H23N2O3- MolecularWeight: 387.45102

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CCCCCC(=O)[O-])(C#N)C2=NC3=CC=CC=C3C=C2

Isomeric SMILES

COC1=CC=C(C=C1)C(CCCCCC(=O)[O-])(C#N)C2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C24H24N2O3/c1-29-20-13-11-19(12-14-20)24(17-25,16-6-2-3-9-23(27)28)22-15-10-18-7-4-5-8-21(18)26-22/h4-5,7-8,10-15H,2-3,6,9,16H2,1H3,(H,27,28)/p-1