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

Systemtic Name: N-[4-bromanyl-1-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]-3-nitro-benzamide Openeye Name: N-[4-bromo-1-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]-3-nitro-benzamide CAS Name: N-[4-bromo-1-[(2,4-dichlorophenyl)methyl]-3-pyrazolyl]-3-nitrobenzamide IUPAC Name: N-[4-bromo-1-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]-3-nitrobenzamide Traditional Name: N-[4-bromo-1-(2,4-dichlorobenzyl)pyrazol-3-yl]-3-nitro-benzamide Formula: C17H11BrCl2N4O3 MolecularWeight: 470.10424

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC2=NN(C=C2Br)CC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC2=NN(C=C2Br)CC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H11BrCl2N4O3/c18-14-9-23(8-11-4-5-12(19)7-15(11)20)22-16(14)21-17(25)10-2-1-3-13(6-10)24(26)27/h1-7,9H,8H2,(H,21,22,25)