ethyl 6-[(4-cyanophenyl)methyl]-7-oxidanyl-heptanoate

Systemtic Name: ethyl 6-[(4-cyanophenyl)methyl]-7-oxidanyl-heptanoate Openeye Name: ethyl 6-[(4-cyanophenyl)methyl]-7-hydroxy-heptanoate CAS Name: 6-[(4-cyanophenyl)methyl]-7-hydroxyheptanoic acid ethyl ester IUPAC Name: ethyl 6-[(4-cyanophenyl)methyl]-7-hydroxyheptanoate Traditional Name: 6-(4-cyanobenzyl)-7-hydroxy-enanthic acid ethyl ester Formula: C17H23NO3 MolecularWeight: 289.36942

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCC(CC1=CC=C(C=C1)C#N)CO

Isomeric SMILES

CCOC(=O)CCCCC(CC1=CC=C(C=C1)C#N)CO

InChI

InChI=1S/C17H23NO3/c1-2-21-17(20)6-4-3-5-16(13-19)11-14-7-9-15(12-18)10-8-14/h7-10,16,19H,2-6,11,13H2,1H3