3-(4-oxidanylidene-8-propyl-chromen-7-yl)oxypropyl thiocyanate

Systemtic Name: 3-(4-oxidanylidene-8-propyl-chromen-7-yl)oxypropyl thiocyanate Openeye Name: 3-(4-oxo-8-propyl-chromen-7-yl)oxypropyl thiocyanate CAS Name: thiocyanic acid 3-[(4-oxo-8-propyl-1-benzopyran-7-yl)oxy]propyl ester IUPAC Name: 3-(4-oxo-8-propylchromen-7-yl)oxypropyl thiocyanate Traditional Name: thiocyanic acid 3-(4-keto-8-propyl-chromen-7-yl)oxypropyl ester Formula: C16H17NO3S MolecularWeight: 303.37608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17NO3S/c1-2-4-13-15(19-8-3-10-21-11-17)6-5-12-14(18)7-9-20-16(12)13/h5-7,9H,2-4,8,10H2,1H3