[4-[2-(4-methoxyphenoxy)butanoylamino]phenyl] thiocyanate

Systemtic Name: [4-[2-(4-methoxyphenoxy)butanoylamino]phenyl] thiocyanate Openeye Name: [4-[2-(4-methoxyphenoxy)butanoylamino]phenyl] thiocyanate CAS Name: thiocyanic acid [4-[[2-(4-methoxyphenoxy)-1-oxobutyl]amino]phenyl] ester IUPAC Name: [4-[2-(4-methoxyphenoxy)butanoylamino]phenyl] thiocyanate Traditional Name: thiocyanic acid [4-[2-(4-methoxyphenoxy)butanoylamino]phenyl] ester Formula: C18H18N2O3S MolecularWeight: 342.41212

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)SC#N)OC2=CC=C(C=C2)OC

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)SC#N)OC2=CC=C(C=C2)OC

InChI

InChI=1S/C18H18N2O3S/c1-3-17(23-15-8-6-14(22-2)7-9-15)18(21)20-13-4-10-16(11-5-13)24-12-19/h4-11,17H,3H2,1-2H3,(H,20,21)