6,6-dimethyl-3-(2-methylprop-1-enyl)-1-(phenylmethyl)-7H-pyrano[4,3-c]pyrazol-4-one

Systemtic Name: 6,6-dimethyl-3-(2-methylprop-1-enyl)-1-(phenylmethyl)-7H-pyrano[4,3-c]pyrazol-4-one Openeye Name: 1-benzyl-6,6-dimethyl-3-(2-methylprop-1-enyl)-7H-pyrano[4,3-c]pyrazol-4-one CAS Name: 6,6-dimethyl-3-(2-methylprop-1-enyl)-1-(phenylmethyl)-7H-pyrano[4,3-c]pyrazol-4-one IUPAC Name: 1-benzyl-6,6-dimethyl-3-(2-methylprop-1-enyl)-7H-pyrano[4,3-c]pyrazol-4-one Traditional Name: 1-benzyl-6,6-dimethyl-3-(2-methylprop-1-enyl)-7H-pyrano[4,3-c]pyrazol-4-one Formula: C19H22N2O2 MolecularWeight: 310.39018

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=NN(C2=C1C(=O)OC(C2)(C)C)CC3=CC=CC=C3)C

Isomeric SMILES

CC(=CC1=NN(C2=C1C(=O)OC(C2)(C)C)CC3=CC=CC=C3)C

InChI

InChI=1S/C19H22N2O2/c1-13(2)10-15-17-16(11-19(3,4)23-18(17)22)21(20-15)12-14-8-6-5-7-9-14/h5-10H,11-12H2,1-4H3