2-[4-(1,3-dithiolan-2-ylideneamino)phenyl]butyl propanoate

Systemtic Name: 2-[4-(1,3-dithiolan-2-ylideneamino)phenyl]butyl propanoate Openeye Name: 2-[4-(1,3-dithiolan-2-ylideneamino)phenyl]butyl propanoate CAS Name: propanoic acid 2-[4-(1,3-dithiolan-2-ylideneamino)phenyl]butyl ester IUPAC Name: 2-[4-(1,3-dithiolan-2-ylideneamino)phenyl]butyl propanoate Traditional Name: propionic acid 2-[4-(1,3-dithiolan-2-ylideneamino)phenyl]butyl ester Formula: C16H21NO2S2 MolecularWeight: 323.47344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(COC(=O)CC)C1=CC=C(C=C1)N=C2SCCS2

Isomeric SMILES

CCC(COC(=O)CC)C1=CC=C(C=C1)N=C2SCCS2

InChI

InChI=1S/C16H21NO2S2/c1-3-12(11-19-15(18)4-2)13-5-7-14(8-6-13)17-16-20-9-10-21-16/h5-8,12H,3-4,9-11H2,1-2H3