(E)-1-(1-methylpyrazol-3-yl)-3-(2,4,5-trimethoxyphenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(1-methylpyrazol-3-yl)-3-(2,4,5-trimethoxyphenyl)prop-2-en-1-one Openeye Name: (E)-1-(1-methylpyrazol-3-yl)-3-(2,4,5-trimethoxyphenyl)prop-2-en-1-one CAS Name: (E)-1-(1-methyl-3-pyrazolyl)-3-(2,4,5-trimethoxyphenyl)-2-propen-1-one IUPAC Name: (E)-1-(1-methylpyrazol-3-yl)-3-(2,4,5-trimethoxyphenyl)prop-2-en-1-one Traditional Name: (E)-3-asaryl-1-(1-methylpyrazol-3-yl)prop-2-en-1-one Formula: C16H18N2O4 MolecularWeight: 302.32512

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=N1)C(=O)C=CC2=CC(=C(C=C2OC)OC)OC

Isomeric SMILES

CN1C=CC(=N1)C(=O)/C=C/C2=CC(=C(C=C2OC)OC)OC

InChI

InChI=1S/C16H18N2O4/c1-18-8-7-12(17-18)13(19)6-5-11-9-15(21-3)16(22-4)10-14(11)20-2/h5-10H,1-4H3/b6-5+