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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(C2=CC(=C(C=C2)F)C)C(=C=O)C3=NN=NN3C)F

Isomeric SMILES

CC1=C(C=CC(=C1)C(C2=CC(=C(C=C2)F)C)C(=C=O)C3=NN=NN3C)F

InChI

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