5,5-dimethyl-2-[3-[(2S)-oxolan-2-yl]-1-(2-phenanthridin-6-ylhydrazinyl)propylidene]cyclohexane-1,3-dione

Systemtic Name: 5,5-dimethyl-2-[3-[(2S)-oxolan-2-yl]-1-(2-phenanthridin-6-ylhydrazinyl)propylidene]cyclohexane-1,3-dione Openeye Name: 5,5-dimethyl-2-[1-(2-phenanthridin-6-ylhydrazino)-3-[(2S)-tetrahydrofuran-2-yl]propylidene]cyclohexane-1,3-dione CAS Name: 5,5-dimethyl-2-[3-[(2S)-2-oxolanyl]-1-(6-phenanthridinylhydrazo)propylidene]cyclohexane-1,3-dione IUPAC Name: 5,5-dimethyl-2-[3-[(2S)-oxolan-2-yl]-1-(2-phenanthridin-6-ylhydrazinyl)propylidene]cyclohexane-1,3-dione Traditional Name: 5,5-dimethyl-2-[1-(N'-phenanthridin-6-ylhydrazino)-3-[(2S)-tetrahydrofuran-2-yl]propylidene]cyclohexane-1,3-quinone Formula: C28H31N3O3 MolecularWeight: 457.56404

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(=C(CCC2CCCO2)NNC3=NC4=CC=CC=C4C5=CC=CC=C53)C(=O)C1)C

Isomeric SMILES

CC1(CC(=O)C(=C(CC[C@H]2CCCO2)NNC3=NC4=CC=CC=C4C5=CC=CC=C53)C(=O)C1)C

InChI

InChI=1S/C28H31N3O3/c1-28(2)16-24(32)26(25(33)17-28)23(14-13-18-8-7-15-34-18)30-31-27-21-11-4-3-9-19(21)20-10-5-6-12-22(20)29-27/h3-6,9-12,18,30H,7-8,13-17H2,1-2H3,(H,29,31)/t18-/m1/s1