(4E)-4-[azanyl(octadecoxy)methylidene]-2-methoxy-cyclohexa-2,5-dien-1-one chloride

Systemtic Name: (4E)-4-[azanyl(octadecoxy)methylidene]-2-methoxy-cyclohexa-2,5-dien-1-one chloride Openeye Name: (4E)-4-[amino(octadecoxy)methylene]-2-methoxy-cyclohexa-2,5-dien-1-one chloride CAS Name: (4E)-4-[amino(octadecoxy)methylidene]-2-methoxy-1-cyclohexa-2,5-dienone chloride IUPAC Name: (4E)-4-[amino(octadecoxy)methylidene]-2-methoxycyclohexa-2,5-dien-1-one chloride Traditional Name: (4E)-4-[amino(stearyloxy)methylene]-2-methoxy-cyclohexa-2,5-dien-1-one chloride Formula: C26H45ClNO3- MolecularWeight: 455.0934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=C1C=CC(=O)C(=C1)OC)N.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCO/C(=C/1\C=CC(=O)C(=C1)OC)/N.[Cl-]

InChI

InChI=1S/C26H45NO3.ClH/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-30-26(27)23-19-20-24(28)25(22-23)29-2;/h19-20,22H,3-18,21,27H2,1-2H3;1H/p-1/b26-23+;