ethyl (E)-4-[(E)-3-(octylamino)-3-oxidanylidene-prop-1-enyl]sulfanyl-4-oxidanylidene-but-2-enoate

Systemtic Name: ethyl (E)-4-[(E)-3-(octylamino)-3-oxidanylidene-prop-1-enyl]sulfanyl-4-oxidanylidene-but-2-enoate Openeye Name: ethyl (E)-4-[(E)-3-(octylamino)-3-oxo-prop-1-enyl]sulfanyl-4-oxo-but-2-enoate CAS Name: (E)-4-[[(E)-3-(octylamino)-3-oxoprop-1-enyl]thio]-4-oxo-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-4-[(E)-3-(octylamino)-3-oxoprop-1-enyl]sulfanyl-4-oxobut-2-enoate Traditional Name: (E)-4-keto-4-[[(E)-3-keto-3-(octylamino)prop-1-enyl]thio]but-2-enoic acid ethyl ester Formula: C17H27NO4S MolecularWeight: 341.46558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=O)C=CSC(=O)C=CC(=O)OCC

Isomeric SMILES

CCCCCCCCNC(=O)/C=C/SC(=O)/C=C/C(=O)OCC

InChI

InChI=1S/C17H27NO4S/c1-3-5-6-7-8-9-13-18-15(19)12-14-23-17(21)11-10-16(20)22-4-2/h10-12,14H,3-9,13H2,1-2H3,(H,18,19)/b11-10+,14-12+