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

Systemtic Name: 4-butoxy-1-butyl-7-[[(2E)-3,7-dimethylocta-2,6-dienyl]amino]-3-hexoxy-quinolin-2-one Openeye Name: 4-butoxy-1-butyl-7-[[(2E)-3,7-dimethylocta-2,6-dienyl]amino]-3-hexoxy-quinolin-2-one CAS Name: 4-butoxy-1-butyl-7-[[(2E)-3,7-dimethylocta-2,6-dienyl]amino]-3-hexoxy-2-quinolinone IUPAC Name: 4-butoxy-1-butyl-7-[[(2E)-3,7-dimethylocta-2,6-dienyl]amino]-3-hexoxyquinolin-2-one Traditional Name: 4-butoxy-1-butyl-7-[[(2E)-3,7-dimethylocta-2,6-dienyl]amino]-3-hexoxy-carbostyril Formula: C33H52N2O3 MolecularWeight: 524.77758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H52N2O3/c1-7-10-13-14-24-38-32-31(37-23-12-9-3)29-19-18-28(25-30(29)35(33(32)36)22-11-8-2)34-21-20-27(6)17-15-16-26(4)5/h16,18-20,25,34H,7-15,17,21-24H2,1-6H3/b27-20+