(5-bromanyl-3-phenylmethoxy-1-propan-2-yl-pyrazol-4-yl)-(4-methoxyphenyl)methanone

Systemtic Name: (5-bromanyl-3-phenylmethoxy-1-propan-2-yl-pyrazol-4-yl)-(4-methoxyphenyl)methanone Openeye Name: (3-benzyloxy-5-bromo-1-isopropyl-pyrazol-4-yl)-(4-methoxyphenyl)methanone CAS Name: (5-bromo-3-phenylmethoxy-1-propan-2-yl-4-pyrazolyl)-(4-methoxyphenyl)methanone IUPAC Name: (5-bromo-3-phenylmethoxy-1-propan-2-ylpyrazol-4-yl)-(4-methoxyphenyl)methanone Traditional Name: (3-benzoxy-5-bromo-1-isopropyl-pyrazol-4-yl)-(4-methoxyphenyl)methanone Formula: C21H21BrN2O3 MolecularWeight: 429.30704

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=C(C(=N1)OCC2=CC=CC=C2)C(=O)C3=CC=C(C=C3)OC)Br

Isomeric SMILES

CC(C)N1C(=C(C(=N1)OCC2=CC=CC=C2)C(=O)C3=CC=C(C=C3)OC)Br

InChI

InChI=1S/C21H21BrN2O3/c1-14(2)24-20(22)18(19(25)16-9-11-17(26-3)12-10-16)21(23-24)27-13-15-7-5-4-6-8-15/h4-12,14H,13H2,1-3H3