7-(4-tert-butylphenoxy)isoquinoline-3-carboxylic acid

Systemtic Name: 7-(4-tert-butylphenoxy)isoquinoline-3-carboxylic acid Openeye Name: 7-(4-tert-butylphenoxy)isoquinoline-3-carboxylic acid CAS Name: 7-(4-tert-butylphenoxy)-3-isoquinolinecarboxylic acid IUPAC Name: 7-(4-tert-butylphenoxy)isoquinoline-3-carboxylic acid Traditional Name: 7-(4-tert-butylphenoxy)isoquinoline-3-carboxylic acid Formula: C20H19NO3 MolecularWeight: 321.36976

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OC2=CC3=CN=C(C=C3C=C2)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OC2=CC3=CN=C(C=C3C=C2)C(=O)O

InChI

InChI=1S/C20H19NO3/c1-20(2,3)15-5-8-16(9-6-15)24-17-7-4-13-11-18(19(22)23)21-12-14(13)10-17/h4-12H,1-3H3,(H,22,23)