4-[3-(2,3-dihydro-1H-inden-5-ylsulfanyl)propoxy]aniline

Systemtic Name: 4-[3-(2,3-dihydro-1H-inden-5-ylsulfanyl)propoxy]aniline Openeye Name: 4-(3-indan-5-ylsulfanylpropoxy)aniline CAS Name: 4-[3-(2,3-dihydro-1H-inden-5-ylthio)propoxy]aniline IUPAC Name: 4-[3-(2,3-dihydro-1H-inden-5-ylsulfanyl)propoxy]aniline Traditional Name: [4-[3-(indan-5-ylthio)propoxy]phenyl]amine Formula: C18H21NOS MolecularWeight: 299.43044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)SCCCOC3=CC=C(C=C3)N

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)SCCCOC3=CC=C(C=C3)N

InChI

InChI=1S/C18H21NOS/c19-16-6-8-17(9-7-16)20-11-2-12-21-18-10-5-14-3-1-4-15(14)13-18/h5-10,13H,1-4,11-12,19H2