2-cyclopropyl-6-methyl-3,5-bis(oxidanyl)-4-phenyl-2-quinolin-3-yl-hept-6-enoic acid

Systemtic Name: 2-cyclopropyl-6-methyl-3,5-bis(oxidanyl)-4-phenyl-2-quinolin-3-yl-hept-6-enoic acid Openeye Name: 2-cyclopropyl-3,5-dihydroxy-6-methyl-4-phenyl-2-(3-quinolyl)hept-6-enoic acid CAS Name: 2-cyclopropyl-3,5-dihydroxy-6-methyl-4-phenyl-2-(3-quinolinyl)-6-heptenoic acid IUPAC Name: 2-cyclopropyl-3,5-dihydroxy-6-methyl-4-phenyl-2-quinolin-3-ylhept-6-enoic acid Traditional Name: 2-cyclopropyl-3,5-dihydroxy-6-methyl-4-phenyl-2-(3-quinolyl)hept-6-enoic acid Formula: C26H27NO4 MolecularWeight: 417.49688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(C(C1=CC=CC=C1)C(C(C2CC2)(C3=CC4=CC=CC=C4N=C3)C(=O)O)O)O

Isomeric SMILES

CC(=C)C(C(C1=CC=CC=C1)C(C(C2CC2)(C3=CC4=CC=CC=C4N=C3)C(=O)O)O)O

InChI

InChI=1S/C26H27NO4/c1-16(2)23(28)22(17-8-4-3-5-9-17)24(29)26(25(30)31,19-12-13-19)20-14-18-10-6-7-11-21(18)27-15-20/h3-11,14-15,19,22-24,28-29H,1,12-13H2,2H3,(H,30,31)