(4-cyanophenyl) 6-heptoxy-5,6,7,8-tetrahydronaphthalene-2-carboxylate

Systemtic Name: (4-cyanophenyl) 6-heptoxy-5,6,7,8-tetrahydronaphthalene-2-carboxylate Openeye Name: (4-cyanophenyl) 2-heptoxytetralin-6-carboxylate CAS Name: 6-heptoxy-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 6-heptoxy-5,6,7,8-tetrahydronaphthalene-2-carboxylate Traditional Name: 2-heptoxytetralin-6-carboxylic acid (4-cyanophenyl) ester Formula: C25H29NO3 MolecularWeight: 391.50266

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1CCC2=C(C1)C=CC(=C2)C(=O)OC3=CC=C(C=C3)C#N

Isomeric SMILES

CCCCCCCOC1CCC2=C(C1)C=CC(=C2)C(=O)OC3=CC=C(C=C3)C#N

InChI

InChI=1S/C25H29NO3/c1-2-3-4-5-6-15-28-24-14-11-20-16-22(10-9-21(20)17-24)25(27)29-23-12-7-19(18-26)8-13-23/h7-10,12-13,16,24H,2-6,11,14-15,17H2,1H3