ethyl 2-[1,4-bis(oxidanylidene)-3-(prop-2-enylamino)naphthalen-2-yl]sulfanylpropanoate

Systemtic Name: ethyl 2-[1,4-bis(oxidanylidene)-3-(prop-2-enylamino)naphthalen-2-yl]sulfanylpropanoate Openeye Name: ethyl 2-[[3-(allylamino)-1,4-dioxo-2-naphthyl]sulfanyl]propanoate CAS Name: 2-[[1,4-dioxo-3-(prop-2-enylamino)-2-naphthalenyl]thio]propanoic acid ethyl ester IUPAC Name: ethyl 2-[1,4-dioxo-3-(prop-2-enylamino)naphthalen-2-yl]sulfanylpropanoate Traditional Name: 2-[[3-(allylamino)-1,4-diketo-2-naphthyl]thio]propionic acid ethyl ester Formula: C18H19NO4S MolecularWeight: 345.41276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)SC1=C(C(=O)C2=CC=CC=C2C1=O)NCC=C

Isomeric SMILES

CCOC(=O)C(C)SC1=C(C(=O)C2=CC=CC=C2C1=O)NCC=C

InChI

InChI=1S/C18H19NO4S/c1-4-10-19-14-15(20)12-8-6-7-9-13(12)16(21)17(14)24-11(3)18(22)23-5-2/h4,6-9,11,19H,1,5,10H2,2-3H3