sodium [4,4-bis(ethoxycarbonyl)-2-[(E)-1-oxidanyl-3-phenyl-prop-2-enyl]hepta-1,6-dienylidene]azanide

Systemtic Name: sodium [4,4-bis(ethoxycarbonyl)-2-[(E)-1-oxidanyl-3-phenyl-prop-2-enyl]hepta-1,6-dienylidene]azanide Openeye Name: sodium [4,4-bis(ethoxycarbonyl)-2-[(E)-1-hydroxy-3-phenyl-allyl]hepta-1,6-dienylidene]azanide CAS Name: sodium [4,4-bis(ethoxycarbonyl)-2-[(E)-1-hydroxy-3-phenylprop-2-enyl]hepta-1,6-dienylidene]azanide IUPAC Name: sodium [4,4-bis(ethoxycarbonyl)-2-[(E)-1-hydroxy-3-phenylprop-2-enyl]hepta-1,6-dienylidene]azanide Traditional Name: sodium [4,4-dicarbethoxy-2-[(E)-1-hydroxy-3-phenyl-allyl]hepta-1,6-dienylidene]azanide Formula: C22H26NNaO5 MolecularWeight: 407.43531

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC=C)(CC(=C=[N-])C(C=CC1=CC=CC=C1)O)C(=O)OCC.[Na+]

Isomeric SMILES

CCOC(=O)C(CC=C)(CC(=C=[N-])C(/C=C/C1=CC=CC=C1)O)C(=O)OCC.[Na+]

InChI

InChI=1S/C22H26NO5.Na/c1-4-14-22(20(25)27-5-2,21(26)28-6-3)15-18(16-23)19(24)13-12-17-10-8-7-9-11-17;/h4,7-13,19,24H,1,5-6,14-15H2,2-3H3;/q-1;+1/b13-12+;