3-[4-(cyclohexylmethoxy)-3-(2-oxidanylidene-1H-quinolin-6-yl)phenyl]propanoic acid

Systemtic Name: 3-[4-(cyclohexylmethoxy)-3-(2-oxidanylidene-1H-quinolin-6-yl)phenyl]propanoic acid Openeye Name: 3-[4-(cyclohexylmethoxy)-3-(2-oxo-1H-quinolin-6-yl)phenyl]propanoic acid CAS Name: 3-[4-(cyclohexylmethoxy)-3-(2-oxo-1H-quinolin-6-yl)phenyl]propanoic acid IUPAC Name: 3-[4-(cyclohexylmethoxy)-3-(2-oxo-1H-quinolin-6-yl)phenyl]propanoic acid Traditional Name: 3-[4-(cyclohexylmethoxy)-3-(2-keto-1H-quinolin-6-yl)phenyl]propionic acid Formula: C25H27NO4 MolecularWeight: 405.48618

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)COC2=C(C=C(C=C2)CCC(=O)O)C3=CC4=C(C=C3)NC(=O)C=C4

Isomeric SMILES

C1CCC(CC1)COC2=C(C=C(C=C2)CCC(=O)O)C3=CC4=C(C=C3)NC(=O)C=C4

InChI

InChI=1S/C25H27NO4/c27-24-12-9-20-15-19(8-10-22(20)26-24)21-14-17(7-13-25(28)29)6-11-23(21)30-16-18-4-2-1-3-5-18/h6,8-12,14-15,18H,1-5,7,13,16H2,(H,26,27)(H,28,29)