1-[(3S)-5-(4-methoxyphenyl)-3-[(E)-2-phenylethenyl]-3,4-dihydropyrazol-2-yl]propan-1-one

Systemtic Name: 1-[(3S)-5-(4-methoxyphenyl)-3-[(E)-2-phenylethenyl]-3,4-dihydropyrazol-2-yl]propan-1-one Openeye Name: 1-[(3S)-5-(4-methoxyphenyl)-3-[(E)-styryl]-3,4-dihydropyrazol-2-yl]propan-1-one CAS Name: 1-[(3S)-5-(4-methoxyphenyl)-3-[(E)-2-phenylethenyl]-3,4-dihydropyrazol-2-yl]-1-propanone IUPAC Name: 1-[(3S)-5-(4-methoxyphenyl)-3-[(E)-2-phenylethenyl]-3,4-dihydropyrazol-2-yl]propan-1-one Traditional Name: 1-[(5S)-3-(4-methoxyphenyl)-5-[(E)-styryl]-2-pyrazolin-1-yl]propan-1-one Formula: C21H22N2O2 MolecularWeight: 334.41158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1C(CC(=N1)C2=CC=C(C=C2)OC)C=CC3=CC=CC=C3

Isomeric SMILES

CCC(=O)N1[C@@H](CC(=N1)C2=CC=C(C=C2)OC)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C21H22N2O2/c1-3-21(24)23-18(12-9-16-7-5-4-6-8-16)15-20(22-23)17-10-13-19(25-2)14-11-17/h4-14,18H,3,15H2,1-2H3/b12-9+/t18-/m1/s1