1-[2-[2,5-dimethyl-1-(oxolan-2-ylmethyl)pyrrol-3-yl]-2-oxidanylidene-ethyl]cinnolin-4-one

Systemtic Name: 1-[2-[2,5-dimethyl-1-(oxolan-2-ylmethyl)pyrrol-3-yl]-2-oxidanylidene-ethyl]cinnolin-4-one Openeye Name: 1-[2-[2,5-dimethyl-1-(tetrahydrofuran-2-ylmethyl)pyrrol-3-yl]-2-oxo-ethyl]cinnolin-4-one CAS Name: 1-[2-[2,5-dimethyl-1-(2-oxolanylmethyl)-3-pyrrolyl]-2-oxoethyl]-4-cinnolinone IUPAC Name: 1-[2-[2,5-dimethyl-1-(oxolan-2-ylmethyl)pyrrol-3-yl]-2-oxoethyl]cinnolin-4-one Traditional Name: 1-[2-[2,5-dimethyl-1-(tetrahydrofurfuryl)pyrrol-3-yl]-2-keto-ethyl]cinnolin-4-one Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2CCCO2)C)C(=O)CN3C4=CC=CC=C4C(=O)C=N3

Isomeric SMILES

CC1=CC(=C(N1CC2CCCO2)C)C(=O)CN3C4=CC=CC=C4C(=O)C=N3

InChI

InChI=1S/C21H23N3O3/c1-14-10-18(15(2)23(14)12-16-6-5-9-27-16)21(26)13-24-19-8-4-3-7-17(19)20(25)11-22-24/h3-4,7-8,10-11,16H,5-6,9,12-13H2,1-2H3