2-[[6-[3-(cyclohexylcarbamoyl)phenoxy]-3-oxidanyl-quinolin-2-yl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[6-[3-(cyclohexylcarbamoyl)phenoxy]-3-oxidanyl-quinolin-2-yl]carbonylamino]ethanoic acid Openeye Name: 2-[[6-[3-(cyclohexylcarbamoyl)phenoxy]-3-hydroxy-quinoline-2-carbonyl]amino]acetic acid CAS Name: 2-[[[6-[3-[(cyclohexylamino)-oxomethyl]phenoxy]-3-hydroxy-2-quinolinyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[6-[3-(cyclohexylcarbamoyl)phenoxy]-3-hydroxyquinoline-2-carbonyl]amino]acetic acid Traditional Name: 2-[[6-[3-(cyclohexylcarbamoyl)phenoxy]-3-hydroxy-quinoline-2-carbonyl]amino]acetic acid Formula: C25H25N3O6 MolecularWeight: 463.4825

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C2=CC(=CC=C2)OC3=CC4=CC(=C(N=C4C=C3)C(=O)NCC(=O)O)O

Isomeric SMILES

C1CCC(CC1)NC(=O)C2=CC(=CC=C2)OC3=CC4=CC(=C(N=C4C=C3)C(=O)NCC(=O)O)O

InChI

InChI=1S/C25H25N3O6/c29-21-13-16-12-19(9-10-20(16)28-23(21)25(33)26-14-22(30)31)34-18-8-4-5-15(11-18)24(32)27-17-6-2-1-3-7-17/h4-5,8-13,17,29H,1-3,6-7,14H2,(H,26,33)(H,27,32)(H,30,31)