3-(3-tert-butyl-5-methyl-1-prop-2-enyl-pyrazol-4-yl)oxy-5-isocyano-benzenecarbonitrile

Systemtic Name: 3-(3-tert-butyl-5-methyl-1-prop-2-enyl-pyrazol-4-yl)oxy-5-isocyano-benzenecarbonitrile Openeye Name: 3-(1-allyl-3-tert-butyl-5-methyl-pyrazol-4-yl)oxy-5-isocyano-benzonitrile CAS Name: 3-[(3-tert-butyl-5-methyl-1-prop-2-enyl-4-pyrazolyl)oxy]-5-isocyanobenzonitrile IUPAC Name: 3-(3-tert-butyl-5-methyl-1-prop-2-enylpyrazol-4-yl)oxy-5-isocyanobenzonitrile Traditional Name: 3-(1-allyl-3-tert-butyl-5-methyl-pyrazol-4-yl)oxy-5-isocyano-benzonitrile Formula: C19H20N4O MolecularWeight: 320.3883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC=C)C(C)(C)C)OC2=CC(=CC(=C2)[N+]#[C-])C#N

Isomeric SMILES

CC1=C(C(=NN1CC=C)C(C)(C)C)OC2=CC(=CC(=C2)[N+]#[C-])C#N

InChI

InChI=1S/C19H20N4O/c1-7-8-23-13(2)17(18(22-23)19(3,4)5)24-16-10-14(12-20)9-15(11-16)21-6/h7,9-11H,1,8H2,2-5H3