(E)-1-(4-chloranyl-1-methyl-pyrazol-3-yl)-3-(4-pentoxyphenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(4-chloranyl-1-methyl-pyrazol-3-yl)-3-(4-pentoxyphenyl)prop-2-en-1-one Openeye Name: (E)-1-(4-chloro-1-methyl-pyrazol-3-yl)-3-(4-pentoxyphenyl)prop-2-en-1-one CAS Name: (E)-1-(4-chloro-1-methyl-3-pyrazolyl)-3-(4-pentoxyphenyl)-2-propen-1-one IUPAC Name: (E)-1-(4-chloro-1-methylpyrazol-3-yl)-3-(4-pentoxyphenyl)prop-2-en-1-one Traditional Name: (E)-3-(4-amoxyphenyl)-1-(4-chloro-1-methyl-pyrazol-3-yl)prop-2-en-1-one Formula: C18H21ClN2O2 MolecularWeight: 332.82454

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C=CC(=O)C2=NN(C=C2Cl)C

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)/C=C/C(=O)C2=NN(C=C2Cl)C

InChI

InChI=1S/C18H21ClN2O2/c1-3-4-5-12-23-15-9-6-14(7-10-15)8-11-17(22)18-16(19)13-21(2)20-18/h6-11,13H,3-5,12H2,1-2H3/b11-8+