3-[(2E)-3,7-dimethylocta-2,6-dienoxy]-4-hexoxy-1-octyl-7-[(phenylmethyl)amino]quinolin-2-one

Systemtic Name: 3-[(2E)-3,7-dimethylocta-2,6-dienoxy]-4-hexoxy-1-octyl-7-[(phenylmethyl)amino]quinolin-2-one Openeye Name: 7-(benzylamino)-3-[(2E)-3,7-dimethylocta-2,6-dienoxy]-4-hexoxy-1-octyl-quinolin-2-one CAS Name: 3-[(2E)-3,7-dimethylocta-2,6-dienoxy]-4-hexoxy-1-octyl-7-[(phenylmethyl)amino]-2-quinolinone IUPAC Name: 7-(benzylamino)-3-[(2E)-3,7-dimethylocta-2,6-dienoxy]-4-hexoxy-1-octylquinolin-2-one Traditional Name: 7-(benzylamino)-3-[(2E)-3,7-dimethylocta-2,6-dienoxy]-4-hexoxy-1-octyl-carbostyril Formula: C40H58N2O3 MolecularWeight: 614.90012

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C2=C(C=CC(=C2)NCC3=CC=CC=C3)C(=C(C1=O)OCC=C(C)CCC=C(C)C)OCCCCCC

Isomeric SMILES

CCCCCCCCN1C2=C(C=CC(=C2)NCC3=CC=CC=C3)C(=C(C1=O)OC/C=C(\C)/CCC=C(C)C)OCCCCCC

InChI

InChI=1S/C40H58N2O3/c1-6-8-10-12-13-17-27-42-37-30-35(41-31-34-22-15-14-16-23-34)24-25-36(37)38(44-28-18-11-9-7-2)39(40(42)43)45-29-26-33(5)21-19-20-32(3)4/h14-16,20,22-26,30,41H,6-13,17-19,21,27-29,31H2,1-5H3/b33-26+