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

Systemtic Name: (5-bromanyl-3-phenylmethoxy-1-propan-2-yl-pyrazol-4-yl)-(2,4-diethoxyphenyl)methanone Openeye Name: (3-benzyloxy-5-bromo-1-isopropyl-pyrazol-4-yl)-(2,4-diethoxyphenyl)methanone CAS Name: (5-bromo-3-phenylmethoxy-1-propan-2-yl-4-pyrazolyl)-(2,4-diethoxyphenyl)methanone IUPAC Name: (5-bromo-3-phenylmethoxy-1-propan-2-ylpyrazol-4-yl)-(2,4-diethoxyphenyl)methanone Traditional Name: (3-benzoxy-5-bromo-1-isopropyl-pyrazol-4-yl)-(2,4-diethoxyphenyl)methanone Formula: C24H27BrN2O4 MolecularWeight: 487.38618

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)C(=O)C2=C(N(N=C2OCC3=CC=CC=C3)C(C)C)Br)OCC

Isomeric SMILES

CCOC1=CC(=C(C=C1)C(=O)C2=C(N(N=C2OCC3=CC=CC=C3)C(C)C)Br)OCC

InChI

InChI=1S/C24H27BrN2O4/c1-5-29-18-12-13-19(20(14-18)30-6-2)22(28)21-23(25)27(16(3)4)26-24(21)31-15-17-10-8-7-9-11-17/h7-14,16H,5-6,15H2,1-4H3