3-[(4-bromanyl-1H-pyrazol-5-yl)amino]-5-(3,5-dimethoxyphenyl)-5-methyl-oxolan-2-one

Systemtic Name: 3-[(4-bromanyl-1H-pyrazol-5-yl)amino]-5-(3,5-dimethoxyphenyl)-5-methyl-oxolan-2-one Openeye Name: 3-[(4-bromo-1H-pyrazol-5-yl)amino]-5-(3,5-dimethoxyphenyl)-5-methyl-tetrahydrofuran-2-one CAS Name: 3-[(4-bromo-1H-pyrazol-5-yl)amino]-5-(3,5-dimethoxyphenyl)-5-methyl-2-oxolanone IUPAC Name: 3-[(4-bromo-1H-pyrazol-5-yl)amino]-5-(3,5-dimethoxyphenyl)-5-methyloxolan-2-one Traditional Name: 3-[(4-bromo-1H-pyrazol-5-yl)amino]-5-(3,5-dimethoxyphenyl)-5-methyl-tetrahydrofuran-2-one Formula: C16H18BrN3O4 MolecularWeight: 396.23582

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C(=O)O1)NC2=C(C=NN2)Br)C3=CC(=CC(=C3)OC)OC

Isomeric SMILES

CC1(CC(C(=O)O1)NC2=C(C=NN2)Br)C3=CC(=CC(=C3)OC)OC

InChI

InChI=1S/C16H18BrN3O4/c1-16(9-4-10(22-2)6-11(5-9)23-3)7-13(15(21)24-16)19-14-12(17)8-18-20-14/h4-6,8,13H,7H2,1-3H3,(H2,18,19,20)