(3E)-3-ethylidene-2-[(2E,4Z)-hepta-2,4,6-trien-3-yl]-4-phenyl-5-propyl-1,2-dihydropyrimidin-3-ium-6-one

Systemtic Name: (3E)-3-ethylidene-2-[(2E,4Z)-hepta-2,4,6-trien-3-yl]-4-phenyl-5-propyl-1,2-dihydropyrimidin-3-ium-6-one Openeye Name: (3E)-3-ethylidene-2-[(1E,2Z)-1-ethylidenepenta-2,4-dienyl]-4-phenyl-5-propyl-1,2-dihydropyrimidin-3-ium-6-one CAS Name: (3E)-3-ethylidene-2-[(2E,4Z)-hepta-2,4,6-trien-3-yl]-4-phenyl-5-propyl-1,2-dihydropyrimidin-3-ium-6-one IUPAC Name: (3E)-3-ethylidene-2-[(2E,4Z)-hepta-2,4,6-trien-3-yl]-4-phenyl-5-propyl-1,2-dihydropyrimidin-3-ium-6-one Traditional Name: (3E)-3-ethylidene-2-[(1E,2Z)-1-ethylidenepenta-2,4-dienyl]-4-phenyl-5-propyl-1,2-dihydropyrimidin-3-ium-6-one Formula: C22H27N2O+ MolecularWeight: 335.46258

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C([N+](=CC)C(NC1=O)C(=CC)C=CC=C)C2=CC=CC=C2

Isomeric SMILES

CCCC1=C(/[N+](=C\C)/C(NC1=O)/C(=C/C)/C=C\C=C)C2=CC=CC=C2

InChI

InChI=1S/C22H26N2O/c1-5-9-14-17(7-3)21-23-22(25)19(13-6-2)20(24(21)8-4)18-15-11-10-12-16-18/h5,7-12,14-16,21H,1,6,13H2,2-4H3/p+1/b14-9-,17-7+,24-8+