2-methyl-5-oxidanyl-4-oxidanylidene-3-(3-oxidanylidenebutyl)-7-(4-phenylbutoxy)-2,3-dihydroquinoline-1-carbaldehyde

Systemtic Name: 2-methyl-5-oxidanyl-4-oxidanylidene-3-(3-oxidanylidenebutyl)-7-(4-phenylbutoxy)-2,3-dihydroquinoline-1-carbaldehyde Openeye Name: 5-hydroxy-2-methyl-4-oxo-3-(3-oxobutyl)-7-(4-phenylbutoxy)-2,3-dihydroquinoline-1-carbaldehyde CAS Name: 5-hydroxy-2-methyl-4-oxo-3-(3-oxobutyl)-7-(4-phenylbutoxy)-2,3-dihydroquinoline-1-carboxaldehyde IUPAC Name: 5-hydroxy-2-methyl-4-oxo-3-(3-oxobutyl)-7-(4-phenylbutoxy)-2,3-dihydroquinoline-1-carbaldehyde Traditional Name: 5-hydroxy-4-keto-3-(3-ketobutyl)-2-methyl-7-(4-phenylbutoxy)-2,3-dihydroquinoline-1-carbaldehyde Formula: C25H29NO5 MolecularWeight: 423.50146

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(=O)C2=C(C=C(C=C2N1C=O)OCCCCC3=CC=CC=C3)O)CCC(=O)C

Isomeric SMILES

CC1C(C(=O)C2=C(C=C(C=C2N1C=O)OCCCCC3=CC=CC=C3)O)CCC(=O)C

InChI

InChI=1S/C25H29NO5/c1-17(28)11-12-21-18(2)26(16-27)22-14-20(15-23(29)24(22)25(21)30)31-13-7-6-10-19-8-4-3-5-9-19/h3-5,8-9,14-16,18,21,29H,6-7,10-13H2,1-2H3