7-[(4-cyanophenoxy)methyl]-2-ethoxycarbonyl-3,4-dihydro-1H-naphthalene-2-carboxylic acid

Systemtic Name: 7-[(4-cyanophenoxy)methyl]-2-ethoxycarbonyl-3,4-dihydro-1H-naphthalene-2-carboxylic acid Openeye Name: 7-[(4-cyanophenoxy)methyl]-2-ethoxycarbonyl-tetralin-2-carboxylic acid CAS Name: 7-[(4-cyanophenoxy)methyl]-2-ethoxycarbonyl-3,4-dihydro-1H-naphthalene-2-carboxylic acid IUPAC Name: 7-[(4-cyanophenoxy)methyl]-2-ethoxycarbonyl-3,4-dihydro-1H-naphthalene-2-carboxylic acid Traditional Name: 2-carbethoxy-7-[(4-cyanophenoxy)methyl]tetralin-2-carboxylic acid Formula: C22H21NO5 MolecularWeight: 379.40584

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCC2=C(C1)C=C(C=C2)COC3=CC=C(C=C3)C#N)C(=O)O

Isomeric SMILES

CCOC(=O)C1(CCC2=C(C1)C=C(C=C2)COC3=CC=C(C=C3)C#N)C(=O)O

InChI

InChI=1S/C22H21NO5/c1-2-27-21(26)22(20(24)25)10-9-17-6-3-16(11-18(17)12-22)14-28-19-7-4-15(13-23)5-8-19/h3-8,11H,2,9-10,12,14H2,1H3,(H,24,25)