propan-2-yl N-[1-[(5-bromanyl-2-phenylmethoxy-phenyl)methyl]-5-methyl-pyrazol-3-yl]carbamate

Systemtic Name: propan-2-yl N-[1-[(5-bromanyl-2-phenylmethoxy-phenyl)methyl]-5-methyl-pyrazol-3-yl]carbamate Openeye Name: isopropyl N-[1-[(2-benzyloxy-5-bromo-phenyl)methyl]-5-methyl-pyrazol-3-yl]carbamate CAS Name: N-[1-[(5-bromo-2-phenylmethoxyphenyl)methyl]-5-methyl-3-pyrazolyl]carbamic acid propan-2-yl ester IUPAC Name: propan-2-yl N-[1-[(5-bromo-2-phenylmethoxyphenyl)methyl]-5-methylpyrazol-3-yl]carbamate Traditional Name: N-[1-(2-benzoxy-5-bromo-benzyl)-5-methyl-pyrazol-3-yl]carbamic acid isopropyl ester Formula: C22H24BrN3O3 MolecularWeight: 458.34826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC2=C(C=CC(=C2)Br)OCC3=CC=CC=C3)NC(=O)OC(C)C

Isomeric SMILES

CC1=CC(=NN1CC2=C(C=CC(=C2)Br)OCC3=CC=CC=C3)NC(=O)OC(C)C

InChI

InChI=1S/C22H24BrN3O3/c1-15(2)29-22(27)24-21-11-16(3)26(25-21)13-18-12-19(23)9-10-20(18)28-14-17-7-5-4-6-8-17/h4-12,15H,13-14H2,1-3H3,(H,24,25,27)