5-[(2,2-diethoxy-3,4-dihydrochromen-5-yl)oxy]pentanenitrile

Systemtic Name: 5-[(2,2-diethoxy-3,4-dihydrochromen-5-yl)oxy]pentanenitrile Openeye Name: 5-(2,2-diethoxychroman-5-yl)oxypentanenitrile CAS Name: 5-[(2,2-diethoxy-3,4-dihydro-2H-1-benzopyran-5-yl)oxy]pentanenitrile IUPAC Name: 5-[(2,2-diethoxy-3,4-dihydrochromen-5-yl)oxy]pentanenitrile Traditional Name: 5-(2,2-diethoxychroman-5-yl)oxyvaleronitrile Formula: C18H25NO4 MolecularWeight: 319.3954

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1(CCC2=C(O1)C=CC=C2OCCCCC#N)OCC

Isomeric SMILES

CCOC1(CCC2=C(O1)C=CC=C2OCCCCC#N)OCC

InChI

InChI=1S/C18H25NO4/c1-3-21-18(22-4-2)12-11-15-16(9-8-10-17(15)23-18)20-14-7-5-6-13-19/h8-10H,3-7,11-12,14H2,1-2H3