3-(2,2-dimethyl-3,4-dihydrochromen-6-yl)-1-(4-methoxyphenyl)sulfonyl-pyrazole

Systemtic Name: 3-(2,2-dimethyl-3,4-dihydrochromen-6-yl)-1-(4-methoxyphenyl)sulfonyl-pyrazole Openeye Name: 3-(2,2-dimethylchroman-6-yl)-1-(4-methoxyphenyl)sulfonyl-pyrazole CAS Name: 3-(2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-6-yl)-1-(4-methoxyphenyl)sulfonylpyrazole IUPAC Name: 3-(2,2-dimethyl-3,4-dihydrochromen-6-yl)-1-(4-methoxyphenyl)sulfonylpyrazole Traditional Name: 3-(2,2-dimethylchroman-6-yl)-1-(4-methoxyphenyl)sulfonyl-pyrazole Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N2O4S/c1-21(2)12-10-16-14-15(4-9-20(16)27-21)19-11-13-23(22-19)28(24,25)18-7-5-17(26-3)6-8-18/h4-9,11,13-14H,10,12H2,1-3H3