4-butyl-7-methoxy-naphthalene-2-carboxylic acid

Systemtic Name: 4-butyl-7-methoxy-naphthalene-2-carboxylic acid Openeye Name: 4-butyl-7-methoxy-naphthalene-2-carboxylic acid CAS Name: 4-butyl-7-methoxy-2-naphthalenecarboxylic acid IUPAC Name: 4-butyl-7-methoxynaphthalene-2-carboxylic acid Traditional Name: 4-butyl-7-methoxy-2-naphthoic acid Formula: C16H18O3 MolecularWeight: 258.31232

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C2C=CC(=CC2=CC(=C1)C(=O)O)OC

Isomeric SMILES

CCCCC1=C2C=CC(=CC2=CC(=C1)C(=O)O)OC

InChI

InChI=1S/C16H18O3/c1-3-4-5-11-8-13(16(17)18)9-12-10-14(19-2)6-7-15(11)12/h6-10H,3-5H2,1-2H3,(H,17,18)