4-pentoxy-4-(2-pentylphenyl)cyclohexa-2,5-diene-1-carboxylate

Systemtic Name: 4-pentoxy-4-(2-pentylphenyl)cyclohexa-2,5-diene-1-carboxylate Openeye Name: 4-pentoxy-4-(2-pentylphenyl)cyclohexa-2,5-diene-1-carboxylate CAS Name: 4-pentoxy-4-(2-pentylphenyl)-1-cyclohexa-2,5-dienecarboxylate IUPAC Name: 4-pentoxy-4-(2-pentylphenyl)cyclohexa-2,5-diene-1-carboxylate Traditional Name: 4-amoxy-4-(2-amylphenyl)cyclohexa-2,5-diene-1-carboxylate Formula: C23H31O3- MolecularWeight: 355.49044

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=CC=C1C2(C=CC(C=C2)C(=O)[O-])OCCCCC

Isomeric SMILES

CCCCCC1=CC=CC=C1C2(C=CC(C=C2)C(=O)[O-])OCCCCC

InChI

InChI=1S/C23H32O3/c1-3-5-7-11-19-12-8-9-13-21(19)23(26-18-10-6-4-2)16-14-20(15-17-23)22(24)25/h8-9,12-17,20H,3-7,10-11,18H2,1-2H3,(H,24,25)/p-1