4-(4-oxidanylidene-8-propyl-chromen-7-yl)oxybutyl thiocyanate

Systemtic Name: 4-(4-oxidanylidene-8-propyl-chromen-7-yl)oxybutyl thiocyanate Openeye Name: 4-(4-oxo-8-propyl-chromen-7-yl)oxybutyl thiocyanate CAS Name: thiocyanic acid 4-[(4-oxo-8-propyl-1-benzopyran-7-yl)oxy]butyl ester IUPAC Name: 4-(4-oxo-8-propylchromen-7-yl)oxybutyl thiocyanate Traditional Name: thiocyanic acid 4-(4-keto-8-propyl-chromen-7-yl)oxybutyl ester Formula: C17H19NO3S MolecularWeight: 317.40266

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1OC=CC2=O)OCCCCSC#N

Isomeric SMILES

CCCC1=C(C=CC2=C1OC=CC2=O)OCCCCSC#N

InChI

InChI=1S/C17H19NO3S/c1-2-5-14-16(20-9-3-4-11-22-12-18)7-6-13-15(19)8-10-21-17(13)14/h6-8,10H,2-5,9,11H2,1H3