(E)-3-[2,5-dimethyl-1-(2-propan-2-ylpyrazol-3-yl)pyrrol-3-yl]-1-(3-methoxy-4-oxidanyl-phenyl)prop-2-en-1-one

Systemtic Name: (E)-3-[2,5-dimethyl-1-(2-propan-2-ylpyrazol-3-yl)pyrrol-3-yl]-1-(3-methoxy-4-oxidanyl-phenyl)prop-2-en-1-one Openeye Name: (E)-1-(4-hydroxy-3-methoxy-phenyl)-3-[1-(2-isopropylpyrazol-3-yl)-2,5-dimethyl-pyrrol-3-yl]prop-2-en-1-one CAS Name: (E)-3-[2,5-dimethyl-1-(2-propan-2-yl-3-pyrazolyl)-3-pyrrolyl]-1-(4-hydroxy-3-methoxyphenyl)-2-propen-1-one IUPAC Name: (E)-3-[2,5-dimethyl-1-(2-propan-2-ylpyrazol-3-yl)pyrrol-3-yl]-1-(4-hydroxy-3-methoxyphenyl)prop-2-en-1-one Traditional Name: (E)-1-(4-hydroxy-3-methoxy-phenyl)-3-[1-(2-isopropylpyrazol-3-yl)-2,5-dimethyl-pyrrol-3-yl]prop-2-en-1-one Formula: C22H25N3O3 MolecularWeight: 379.4522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=NN2C(C)C)C)C=CC(=O)C3=CC(=C(C=C3)O)OC

Isomeric SMILES

CC1=CC(=C(N1C2=CC=NN2C(C)C)C)/C=C/C(=O)C3=CC(=C(C=C3)O)OC

InChI

InChI=1S/C22H25N3O3/c1-14(2)25-22(10-11-23-25)24-15(3)12-17(16(24)4)6-8-19(26)18-7-9-20(27)21(13-18)28-5/h6-14,27H,1-5H3/b8-6+