3-[(3-cyclopentyloxy-4-methoxy-phenyl)-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]amino]benzoic acid

Systemtic Name: 3-[(3-cyclopentyloxy-4-methoxy-phenyl)-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]amino]benzoic acid Openeye Name: 3-[3-(cyclopentoxy)-N-[(3,5-dimethylisoxazol-4-yl)methyl]-4-methoxy-anilino]benzoic acid CAS Name: 3-[3-cyclopentyloxy-N-[(3,5-dimethyl-4-isoxazolyl)methyl]-4-methoxyanilino]benzoic acid IUPAC Name: 3-[3-cyclopentyloxy-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-methoxyanilino]benzoic acid Traditional Name: 3-[3-(cyclopentoxy)-N-[(3,5-dimethylisoxazol-4-yl)methyl]-4-methoxy-anilino]benzoic acid Formula: C25H28N2O5 MolecularWeight: 436.50022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CN(C2=CC(=C(C=C2)OC)OC3CCCC3)C4=CC=CC(=C4)C(=O)O

Isomeric SMILES

CC1=C(C(=NO1)C)CN(C2=CC(=C(C=C2)OC)OC3CCCC3)C4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C25H28N2O5/c1-16-22(17(2)32-26-16)15-27(19-8-6-7-18(13-19)25(28)29)20-11-12-23(30-3)24(14-20)31-21-9-4-5-10-21/h6-8,11-14,21H,4-5,9-10,15H2,1-3H3,(H,28,29)