2-deuterio-2-methyl-5-oxidanyl-4-oxidanylidene-3-(3-oxidanylidenebutyl)-7-(5-phenylpentan-2-yloxy)quinoline-1,3-dicarbaldehyde

Systemtic Name: 2-deuterio-2-methyl-5-oxidanyl-4-oxidanylidene-3-(3-oxidanylidenebutyl)-7-(5-phenylpentan-2-yloxy)quinoline-1,3-dicarbaldehyde Openeye Name: 2-deuterio-5-hydroxy-2-methyl-7-(1-methyl-4-phenyl-butoxy)-4-oxo-3-(3-oxobutyl)quinoline-1,3-dicarbaldehyde CAS Name: 2-deuterio-5-hydroxy-2-methyl-4-oxo-3-(3-oxobutyl)-7-(5-phenylpentan-2-yloxy)quinoline-1,3-dicarboxaldehyde IUPAC Name: 2-deuterio-5-hydroxy-2-methyl-4-oxo-3-(3-oxobutyl)-7-(5-phenylpentan-2-yloxy)quinoline-1,3-dicarbaldehyde Traditional Name: 2-deuterio-5-hydroxy-4-keto-3-(3-ketobutyl)-2-methyl-7-(1-methyl-4-phenyl-butoxy)quinoline-1,3-dicarbaldehyde Formula: C27H31NO6 MolecularWeight: 466.544302

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(=O)C2=C(C=C(C=C2N1C=O)OC(C)CCCC3=CC=CC=C3)O)(CCC(=O)C)C=O

Isomeric SMILES

[2H]C1(C(C(=O)C2=C(C=C(C=C2N1C=O)OC(C)CCCC3=CC=CC=C3)O)(CCC(=O)C)C=O)C

InChI

InChI=1S/C27H31NO6/c1-18(31)12-13-27(16-29)20(3)28(17-30)23-14-22(15-24(32)25(23)26(27)33)34-19(2)8-7-11-21-9-5-4-6-10-21/h4-6,9-10,14-17,19-20,32H,7-8,11-13H2,1-3H3/i20D