4-(4-bromanylpyrazol-1-yl)-N-(3-phenoxypropyl)benzamide

Systemtic Name: 4-(4-bromanylpyrazol-1-yl)-N-(3-phenoxypropyl)benzamide Openeye Name: 4-(4-bromopyrazol-1-yl)-N-(3-phenoxypropyl)benzamide CAS Name: 4-(4-bromo-1-pyrazolyl)-N-(3-phenoxypropyl)benzamide IUPAC Name: 4-(4-bromopyrazol-1-yl)-N-(3-phenoxypropyl)benzamide Traditional Name: 4-(4-bromopyrazol-1-yl)-N-(3-phenoxypropyl)benzamide Formula: C19H18BrN3O2 MolecularWeight: 400.26912

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCCNC(=O)C2=CC=C(C=C2)N3C=C(C=N3)Br

Isomeric SMILES

C1=CC=C(C=C1)OCCCNC(=O)C2=CC=C(C=C2)N3C=C(C=N3)Br

InChI

InChI=1S/C19H18BrN3O2/c20-16-13-22-23(14-16)17-9-7-15(8-10-17)19(24)21-11-4-12-25-18-5-2-1-3-6-18/h1-3,5-10,13-14H,4,11-12H2,(H,21,24)