ethyl (E)-3-[1,4-bis(oxidanyl)naphthalen-2-yl]sulfanylbut-2-enoate

Systemtic Name: ethyl (E)-3-[1,4-bis(oxidanyl)naphthalen-2-yl]sulfanylbut-2-enoate Openeye Name: ethyl (E)-3-[(1,4-dihydroxy-2-naphthyl)sulfanyl]but-2-enoate CAS Name: (E)-3-[(1,4-dihydroxy-2-naphthalenyl)thio]-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-3-(1,4-dihydroxynaphthalen-2-yl)sulfanylbut-2-enoate Traditional Name: (E)-3-[(1,4-dihydroxy-2-naphthyl)thio]but-2-enoic acid ethyl ester Formula: C16H16O4S MolecularWeight: 304.36084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C)SC1=C(C2=CC=CC=C2C(=C1)O)O

Isomeric SMILES

CCOC(=O)/C=C(\C)/SC1=C(C2=CC=CC=C2C(=C1)O)O

InChI

InChI=1S/C16H16O4S/c1-3-20-15(18)8-10(2)21-14-9-13(17)11-6-4-5-7-12(11)16(14)19/h4-9,17,19H,3H2,1-2H3/b10-8+