2-[2-(2-oxidanylidenechromen-3-yl)oxyethyl]tetradecanenitrile

Systemtic Name: 2-[2-(2-oxidanylidenechromen-3-yl)oxyethyl]tetradecanenitrile Openeye Name: 2-[2-(2-oxochromen-3-yl)oxyethyl]tetradecanenitrile CAS Name: 2-[2-[(2-oxo-1-benzopyran-3-yl)oxy]ethyl]tetradecanenitrile IUPAC Name: 2-[2-(2-oxochromen-3-yl)oxyethyl]tetradecanenitrile Traditional Name: 2-[2-(2-ketochromen-3-yl)oxyethyl]myristonitrile Formula: C25H35NO3 MolecularWeight: 397.5503

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CCOC1=CC2=CC=CC=C2OC1=O)C#N

Isomeric SMILES

CCCCCCCCCCCCC(CCOC1=CC2=CC=CC=C2OC1=O)C#N

InChI

InChI=1S/C25H35NO3/c1-2-3-4-5-6-7-8-9-10-11-14-21(20-26)17-18-28-24-19-22-15-12-13-16-23(22)29-25(24)27/h12-13,15-16,19,21H,2-11,14,17-18H2,1H3