N-[2-[[2,3-bis(chloranyl)phenyl]methyl]pyrazol-3-yl]-4-butoxy-benzamide

Systemtic Name: N-[2-[[2,3-bis(chloranyl)phenyl]methyl]pyrazol-3-yl]-4-butoxy-benzamide Openeye Name: 4-butoxy-N-[2-[(2,3-dichlorophenyl)methyl]pyrazol-3-yl]benzamide CAS Name: 4-butoxy-N-[2-[(2,3-dichlorophenyl)methyl]-3-pyrazolyl]benzamide IUPAC Name: 4-butoxy-N-[2-[(2,3-dichlorophenyl)methyl]pyrazol-3-yl]benzamide Traditional Name: 4-butoxy-N-[2-(2,3-dichlorobenzyl)pyrazol-3-yl]benzamide Formula: C21H21Cl2N3O2 MolecularWeight: 418.31634

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC=NN2CC3=C(C(=CC=C3)Cl)Cl

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC=NN2CC3=C(C(=CC=C3)Cl)Cl

InChI

InChI=1S/C21H21Cl2N3O2/c1-2-3-13-28-17-9-7-15(8-10-17)21(27)25-19-11-12-24-26(19)14-16-5-4-6-18(22)20(16)23/h4-12H,2-3,13-14H2,1H3,(H,25,27)