(E)-1-(azepan-1-yl)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-en-1-one

Systemtic Name: (E)-1-(azepan-1-yl)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-en-1-one Openeye Name: (E)-1-(azepan-1-yl)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-en-1-one CAS Name: (E)-1-(1-azepanyl)-3-(1,3,5-trimethyl-4-pyrazolyl)-2-propen-1-one IUPAC Name: (E)-1-(azepan-1-yl)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-en-1-one Traditional Name: (E)-1-(azepan-1-yl)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-en-1-one Formula: C15H23N3O MolecularWeight: 261.36262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)C=CC(=O)N2CCCCCC2

Isomeric SMILES

CC1=C(C(=NN1C)C)/C=C/C(=O)N2CCCCCC2

InChI

InChI=1S/C15H23N3O/c1-12-14(13(2)17(3)16-12)8-9-15(19)18-10-6-4-5-7-11-18/h8-9H,4-7,10-11H2,1-3H3/b9-8+