diethyl-[4-[(2E)-1,5,5-tris[4-(diethylamino)phenyl]penta-2,4-dienyl]phenyl]azanium iodide

Systemtic Name: diethyl-[4-[(2E)-1,5,5-tris[4-(diethylamino)phenyl]penta-2,4-dienyl]phenyl]azanium iodide Openeye Name: diethyl-[4-[(2E)-1,5,5-tris[4-(diethylamino)phenyl]penta-2,4-dienyl]phenyl]ammonium iodide CAS Name: diethyl-[4-[(2E)-1,5,5-tris[4-(diethylamino)phenyl]penta-2,4-dienyl]phenyl]ammonium iodide IUPAC Name: diethyl-[4-[(2E)-1,5,5-tris[4-(diethylamino)phenyl]penta-2,4-dienyl]phenyl]azanium iodide Traditional Name: diethyl-[4-[(2E)-1,5,5-tris[4-(diethylamino)phenyl]penta-2,4-dienyl]phenyl]ammonium iodide Formula: C45H61IN4 MolecularWeight: 784.89711

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C1=CC=C(C=C1)C(C=CC=C(C2=CC=C(C=C2)N(CC)CC)C3=CC=C(C=C3)N(CC)CC)C4=CC=C(C=C4)N(CC)CC.[I-]

Isomeric SMILES

CC[NH+](CC)C1=CC=C(C=C1)C(/C=C/C=C(C2=CC=C(C=C2)N(CC)CC)C3=CC=C(C=C3)N(CC)CC)C4=CC=C(C=C4)N(CC)CC.[I-]

InChI

InChI=1S/C45H60N4.HI/c1-9-46(10-2)40-28-20-36(21-29-40)44(37-22-30-41(31-23-37)47(11-3)12-4)18-17-19-45(38-24-32-42(33-25-38)48(13-5)14-6)39-26-34-43(35-27-39)49(15-7)16-8;/h17-35,44H,9-16H2,1-8H3;1H/b18-17+;