(4E)-2-azanyl-4-(5-dodecyl-1H-pyrimidin-2-ylidene)cyclohexa-2,5-dien-1-one

Systemtic Name: (4E)-2-azanyl-4-(5-dodecyl-1H-pyrimidin-2-ylidene)cyclohexa-2,5-dien-1-one Openeye Name: (4E)-2-amino-4-(5-dodecyl-1H-pyrimidin-2-ylidene)cyclohexa-2,5-dien-1-one CAS Name: (4E)-2-amino-4-(5-dodecyl-1H-pyrimidin-2-ylidene)-1-cyclohexa-2,5-dienone IUPAC Name: (4E)-2-amino-4-(5-dodecyl-1H-pyrimidin-2-ylidene)cyclohexa-2,5-dien-1-one Traditional Name: (4E)-2-amino-4-(5-lauryl-1H-pyrimidin-2-ylidene)cyclohexa-2,5-dien-1-one Formula: C22H33N3O MolecularWeight: 355.51692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CNC(=C2C=CC(=O)C(=C2)N)N=C1

Isomeric SMILES

CCCCCCCCCCCCC1=CN/C(=C\2/C=CC(=O)C(=C2)N)/N=C1

InChI

InChI=1S/C22H33N3O/c1-2-3-4-5-6-7-8-9-10-11-12-18-16-24-22(25-17-18)19-13-14-21(26)20(23)15-19/h13-17,24H,2-12,23H2,1H3/b22-19+