ethyl 9-(6-cyano-2-methyl-4-oxidanyl-3,4-dihydrochromen-2-yl)nonanoate

Systemtic Name: ethyl 9-(6-cyano-2-methyl-4-oxidanyl-3,4-dihydrochromen-2-yl)nonanoate Openeye Name: ethyl 9-(6-cyano-4-hydroxy-2-methyl-chroman-2-yl)nonanoate CAS Name: 9-(6-cyano-4-hydroxy-2-methyl-3,4-dihydro-2H-1-benzopyran-2-yl)nonanoic acid ethyl ester IUPAC Name: ethyl 9-(6-cyano-4-hydroxy-2-methyl-3,4-dihydrochromen-2-yl)nonanoate Traditional Name: 9-(6-cyano-4-hydroxy-2-methyl-chroman-2-yl)pelargonic acid ethyl ester Formula: C22H31NO4 MolecularWeight: 373.48584

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCCCCCC1(CC(C2=C(O1)C=CC(=C2)C#N)O)C

Isomeric SMILES

CCOC(=O)CCCCCCCCC1(CC(C2=C(O1)C=CC(=C2)C#N)O)C

InChI

InChI=1S/C22H31NO4/c1-3-26-21(25)10-8-6-4-5-7-9-13-22(2)15-19(24)18-14-17(16-23)11-12-20(18)27-22/h11-12,14,19,24H,3-10,13,15H2,1-2H3