N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-5-methyl-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-5-methyl-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-5-methyl-1-phenyl-pyrazole-4-carboxamide CAS Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-5-methyl-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-5-methyl-1-phenylpyrazole-4-carboxamide Traditional Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-5-methyl-1-phenyl-pyrazole-4-carboxamide Formula: C20H19N3O3 MolecularWeight: 349.38316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=CC=C2)C(=O)NCC3COC4=CC=CC=C4O3

Isomeric SMILES

CC1=C(C=NN1C2=CC=CC=C2)C(=O)NC[C@H]3COC4=CC=CC=C4O3

InChI

InChI=1S/C20H19N3O3/c1-14-17(12-22-23(14)15-7-3-2-4-8-15)20(24)21-11-16-13-25-18-9-5-6-10-19(18)26-16/h2-10,12,16H,11,13H2,1H3,(H,21,24)/t16-/m0/s1