N-[4-bromanyl-1-[(4-methylphenyl)methyl]pyrazol-3-yl]-2,3-dimethoxy-benzamide

Systemtic Name: N-[4-bromanyl-1-[(4-methylphenyl)methyl]pyrazol-3-yl]-2,3-dimethoxy-benzamide Openeye Name: N-[4-bromo-1-(p-tolylmethyl)pyrazol-3-yl]-2,3-dimethoxy-benzamide CAS Name: N-[4-bromo-1-[(4-methylphenyl)methyl]-3-pyrazolyl]-2,3-dimethoxybenzamide IUPAC Name: N-[4-bromo-1-[(4-methylphenyl)methyl]pyrazol-3-yl]-2,3-dimethoxybenzamide Traditional Name: N-[4-bromo-1-(4-methylbenzyl)pyrazol-3-yl]-2,3-dimethoxy-benzamide Formula: C20H20BrN3O3 MolecularWeight: 430.2951

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C=C(C(=N2)NC(=O)C3=C(C(=CC=C3)OC)OC)Br

Isomeric SMILES

CC1=CC=C(C=C1)CN2C=C(C(=N2)NC(=O)C3=C(C(=CC=C3)OC)OC)Br

InChI

InChI=1S/C20H20BrN3O3/c1-13-7-9-14(10-8-13)11-24-12-16(21)19(23-24)22-20(25)15-5-4-6-17(26-2)18(15)27-3/h4-10,12H,11H2,1-3H3,(H,22,23,25)