3,3-bis(2-fluoranyl-4-methyl-phenyl)-2-(1-methyl-1,2,3,4-tetrazol-5-yl)prop-2-enal

Systemtic Name: 3,3-bis(2-fluoranyl-4-methyl-phenyl)-2-(1-methyl-1,2,3,4-tetrazol-5-yl)prop-2-enal Openeye Name: 3,3-bis(2-fluoro-4-methyl-phenyl)-2-(1-methyltetrazol-5-yl)prop-2-enal CAS Name: 3,3-bis(2-fluoro-4-methylphenyl)-2-(1-methyl-5-tetrazolyl)-2-propenal IUPAC Name: 3,3-bis(2-fluoro-4-methylphenyl)-2-(1-methyltetrazol-5-yl)prop-2-enal Traditional Name: 3,3-bis(2-fluoro-4-methyl-phenyl)-2-(1-methyltetrazol-5-yl)acrolein Formula: C19H16F2N4O MolecularWeight: 354.353346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=C(C=O)C2=NN=NN2C)C3=C(C=C(C=C3)C)F)F

Isomeric SMILES

CC1=CC(=C(C=C1)C(=C(C=O)C2=NN=NN2C)C3=C(C=C(C=C3)C)F)F

InChI

InChI=1S/C19H16F2N4O/c1-11-4-6-13(16(20)8-11)18(14-7-5-12(2)9-17(14)21)15(10-26)19-22-23-24-25(19)3/h4-10H,1-3H3