2-[(3-cyclopentyloxy-4-methoxy-phenyl)-(pyridazin-3-ylmethyl)amino]benzoic acid

Systemtic Name: 2-[(3-cyclopentyloxy-4-methoxy-phenyl)-(pyridazin-3-ylmethyl)amino]benzoic acid Openeye Name: 2-[3-(cyclopentoxy)-4-methoxy-N-(pyridazin-3-ylmethyl)anilino]benzoic acid CAS Name: 2-[3-cyclopentyloxy-4-methoxy-N-(3-pyridazinylmethyl)anilino]benzoic acid IUPAC Name: 2-[3-cyclopentyloxy-4-methoxy-N-(pyridazin-3-ylmethyl)anilino]benzoic acid Traditional Name: 2-[3-(cyclopentoxy)-4-methoxy-N-(pyridazin-3-ylmethyl)anilino]benzoic acid Formula: C24H25N3O4 MolecularWeight: 419.473

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N(CC2=NN=CC=C2)C3=CC=CC=C3C(=O)O)OC4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)N(CC2=NN=CC=C2)C3=CC=CC=C3C(=O)O)OC4CCCC4

InChI

InChI=1S/C24H25N3O4/c1-30-22-13-12-18(15-23(22)31-19-8-2-3-9-19)27(16-17-7-6-14-25-26-17)21-11-5-4-10-20(21)24(28)29/h4-7,10-15,19H,2-3,8-9,16H2,1H3,(H,28,29)