(E)-1-(1,2-dihydroacenaphthylen-3-yl)-3-[1-(phenylmethyl)pyrazol-4-yl]prop-2-en-1-one

Systemtic Name: (E)-1-(1,2-dihydroacenaphthylen-3-yl)-3-[1-(phenylmethyl)pyrazol-4-yl]prop-2-en-1-one Openeye Name: (E)-3-(1-benzylpyrazol-4-yl)-1-(1,2-dihydroacenaphthylen-3-yl)prop-2-en-1-one CAS Name: (E)-1-(1,2-dihydroacenaphthylen-3-yl)-3-[1-(phenylmethyl)-4-pyrazolyl]-2-propen-1-one IUPAC Name: (E)-3-(1-benzylpyrazol-4-yl)-1-(1,2-dihydroacenaphthylen-3-yl)prop-2-en-1-one Traditional Name: (E)-1-acenaphthen-3-yl-3-(1-benzylpyrazol-4-yl)prop-2-en-1-one Formula: C25H20N2O MolecularWeight: 364.4391

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC3=C2C1=CC=C3)C(=O)C=CC4=CN(N=C4)CC5=CC=CC=C5

Isomeric SMILES

C1CC2=C(C=CC3=C2C1=CC=C3)C(=O)/C=C/C4=CN(N=C4)CC5=CC=CC=C5

InChI

InChI=1S/C25H20N2O/c28-24(22-12-10-20-7-4-8-21-11-13-23(22)25(20)21)14-9-19-15-26-27(17-19)16-18-5-2-1-3-6-18/h1-10,12,14-15,17H,11,13,16H2/b14-9+