N-[4-bromanyl-1-[(4-chlorophenyl)methyl]pyrazol-3-yl]-3,4,5-trimethoxy-benzamide

Systemtic Name: N-[4-bromanyl-1-[(4-chlorophenyl)methyl]pyrazol-3-yl]-3,4,5-trimethoxy-benzamide Openeye Name: N-[4-bromo-1-[(4-chlorophenyl)methyl]pyrazol-3-yl]-3,4,5-trimethoxy-benzamide CAS Name: N-[4-bromo-1-[(4-chlorophenyl)methyl]-3-pyrazolyl]-3,4,5-trimethoxybenzamide IUPAC Name: N-[4-bromo-1-[(4-chlorophenyl)methyl]pyrazol-3-yl]-3,4,5-trimethoxybenzamide Traditional Name: N-[4-bromo-1-(4-chlorobenzyl)pyrazol-3-yl]-3,4,5-trimethoxy-benzamide Formula: C20H19BrClN3O4 MolecularWeight: 480.73956

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NC2=NN(C=C2Br)CC3=CC=C(C=C3)Cl

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NC2=NN(C=C2Br)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H19BrClN3O4/c1-27-16-8-13(9-17(28-2)18(16)29-3)20(26)23-19-15(21)11-25(24-19)10-12-4-6-14(22)7-5-12/h4-9,11H,10H2,1-3H3,(H,23,24,26)