(4-chlorophenyl)-[3-(2,2-dimethyl-3,4-dihydrochromen-6-yl)pyrazol-1-yl]methanone

Systemtic Name: (4-chlorophenyl)-[3-(2,2-dimethyl-3,4-dihydrochromen-6-yl)pyrazol-1-yl]methanone Openeye Name: (4-chlorophenyl)-[3-(2,2-dimethylchroman-6-yl)pyrazol-1-yl]methanone CAS Name: (4-chlorophenyl)-[3-(2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-6-yl)-1-pyrazolyl]methanone IUPAC Name: (4-chlorophenyl)-[3-(2,2-dimethyl-3,4-dihydrochromen-6-yl)pyrazol-1-yl]methanone Traditional Name: (4-chlorophenyl)-[3-(2,2-dimethylchroman-6-yl)pyrazol-1-yl]methanone Formula: C21H19ClN2O2 MolecularWeight: 366.84076

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC2=C(O1)C=CC(=C2)C3=NN(C=C3)C(=O)C4=CC=C(C=C4)Cl)C

Isomeric SMILES

CC1(CCC2=C(O1)C=CC(=C2)C3=NN(C=C3)C(=O)C4=CC=C(C=C4)Cl)C

InChI

InChI=1S/C21H19ClN2O2/c1-21(2)11-9-16-13-15(5-8-19(16)26-21)18-10-12-24(23-18)20(25)14-3-6-17(22)7-4-14/h3-8,10,12-13H,9,11H2,1-2H3