1-butyl-7-[[(2E)-3,7-dimethylocta-2,6-dienyl]amino]-3-hexoxy-2-oxidanyl-quinolin-4-one

Systemtic Name: 1-butyl-7-[[(2E)-3,7-dimethylocta-2,6-dienyl]amino]-3-hexoxy-2-oxidanyl-quinolin-4-one Openeye Name: 1-butyl-7-[[(2E)-3,7-dimethylocta-2,6-dienyl]amino]-3-hexoxy-2-hydroxy-quinolin-4-one CAS Name: 1-butyl-7-[[(2E)-3,7-dimethylocta-2,6-dienyl]amino]-3-hexoxy-2-hydroxy-4-quinolinone IUPAC Name: 1-butyl-7-[[(2E)-3,7-dimethylocta-2,6-dienyl]amino]-3-hexoxy-2-hydroxyquinolin-4-one Traditional Name: 1-butyl-7-[[(2E)-3,7-dimethylocta-2,6-dienyl]amino]-3-hexoxy-2-hydroxy-4-quinolone Formula: C29H44N2O3 MolecularWeight: 468.67126

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(N(C2=C(C1=O)C=CC(=C2)NCC=C(C)CCC=C(C)C)CCCC)O

Isomeric SMILES

CCCCCCOC1=C(N(C2=C(C1=O)C=CC(=C2)NC/C=C(\C)/CCC=C(C)C)CCCC)O

InChI

InChI=1S/C29H44N2O3/c1-6-8-10-11-20-34-28-27(32)25-16-15-24(21-26(25)31(29(28)33)19-9-7-2)30-18-17-23(5)14-12-13-22(3)4/h13,15-17,21,30,33H,6-12,14,18-20H2,1-5H3/b23-17+