1-[(3S)-3-(1,3-benzodioxol-5-yl)-5-naphthalen-2-yl-3,4-dihydropyrazol-2-yl]ethanone

Systemtic Name: 1-[(3S)-3-(1,3-benzodioxol-5-yl)-5-naphthalen-2-yl-3,4-dihydropyrazol-2-yl]ethanone Openeye Name: 1-[(3S)-3-(1,3-benzodioxol-5-yl)-5-(2-naphthyl)-3,4-dihydropyrazol-2-yl]ethanone CAS Name: 1-[(3S)-3-(1,3-benzodioxol-5-yl)-5-(2-naphthalenyl)-3,4-dihydropyrazol-2-yl]ethanone IUPAC Name: 1-[(3S)-3-(1,3-benzodioxol-5-yl)-5-naphthalen-2-yl-3,4-dihydropyrazol-2-yl]ethanone Traditional Name: 1-[(5S)-5-(1,3-benzodioxol-5-yl)-3-(2-naphthyl)-2-pyrazolin-1-yl]ethanone Formula: C22H18N2O3 MolecularWeight: 358.38992

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(CC(=N1)C2=CC3=CC=CC=C3C=C2)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC(=O)N1[C@@H](CC(=N1)C2=CC3=CC=CC=C3C=C2)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H18N2O3/c1-14(25)24-20(18-8-9-21-22(11-18)27-13-26-21)12-19(23-24)17-7-6-15-4-2-3-5-16(15)10-17/h2-11,20H,12-13H2,1H3/t20-/m0/s1