2-[6-[2-[(1-carboxycyclopentyl)methylcarbamoyloxy]butyl]quinolin-2-yl]benzoic acid

Systemtic Name: 2-[6-[2-[(1-carboxycyclopentyl)methylcarbamoyloxy]butyl]quinolin-2-yl]benzoic acid Openeye Name: 2-[6-[2-[(1-carboxycyclopentyl)methylcarbamoyloxy]butyl]-2-quinolyl]benzoic acid CAS Name: 2-[6-[2-[[(1-carboxycyclopentyl)methylamino]-oxomethoxy]butyl]-2-quinolinyl]benzoic acid IUPAC Name: 2-[6-[2-[(1-carboxycyclopentyl)methylcarbamoyloxy]butyl]quinolin-2-yl]benzoic acid Traditional Name: 2-[6-[2-[(1-carboxycyclopentyl)methylcarbamoyloxy]butyl]-2-quinolyl]benzoic acid Formula: C28H30N2O6 MolecularWeight: 490.5476

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC2=C(C=C1)N=C(C=C2)C3=CC=CC=C3C(=O)O)OC(=O)NCC4(CCCC4)C(=O)O

Isomeric SMILES

CCC(CC1=CC2=C(C=C1)N=C(C=C2)C3=CC=CC=C3C(=O)O)OC(=O)NCC4(CCCC4)C(=O)O

InChI

InChI=1S/C28H30N2O6/c1-2-20(36-27(35)29-17-28(26(33)34)13-5-6-14-28)16-18-9-11-23-19(15-18)10-12-24(30-23)21-7-3-4-8-22(21)25(31)32/h3-4,7-12,15,20H,2,5-6,13-14,16-17H2,1H3,(H,29,35)(H,31,32)(H,33,34)