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

Systemtic Name: 1-butyl-7-[[(2E)-3,7-dimethylocta-2,6-dienyl]amino]-3-octoxy-2-oxidanyl-quinolin-4-one Openeye Name: 1-butyl-7-[[(2E)-3,7-dimethylocta-2,6-dienyl]amino]-2-hydroxy-3-octoxy-quinolin-4-one CAS Name: 1-butyl-7-[[(2E)-3,7-dimethylocta-2,6-dienyl]amino]-2-hydroxy-3-octoxy-4-quinolinone IUPAC Name: 1-butyl-7-[[(2E)-3,7-dimethylocta-2,6-dienyl]amino]-2-hydroxy-3-octoxyquinolin-4-one Traditional Name: 1-butyl-7-[[(2E)-3,7-dimethylocta-2,6-dienyl]amino]-2-hydroxy-3-octoxy-4-quinolone Formula: C31H48N2O3 MolecularWeight: 496.72442

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(N(C2=C(C1=O)C=CC(=C2)NCC=C(C)CCC=C(C)C)CCCC)O

Isomeric SMILES

CCCCCCCCOC1=C(N(C2=C(C1=O)C=CC(=C2)NC/C=C(\C)/CCC=C(C)C)CCCC)O

InChI

InChI=1S/C31H48N2O3/c1-6-8-10-11-12-13-22-36-30-29(34)27-18-17-26(23-28(27)33(31(30)35)21-9-7-2)32-20-19-25(5)16-14-15-24(3)4/h15,17-19,23,32,35H,6-14,16,20-22H2,1-5H3/b25-19+