1-[2-(2-chloranylpyridin-3-yl)carbonylpyrazolidin-1-yl]-3-(2,5-dimethoxyphenyl)prop-2-en-1-one

Systemtic Name: 1-[2-(2-chloranylpyridin-3-yl)carbonylpyrazolidin-1-yl]-3-(2,5-dimethoxyphenyl)prop-2-en-1-one Openeye Name: 1-[2-(2-chloropyridine-3-carbonyl)pyrazolidin-1-yl]-3-(2,5-dimethoxyphenyl)prop-2-en-1-one CAS Name: 1-[2-[(2-chloro-3-pyridinyl)-oxomethyl]-1-pyrazolidinyl]-3-(2,5-dimethoxyphenyl)-2-propen-1-one IUPAC Name: 1-[2-(2-chloropyridine-3-carbonyl)pyrazolidin-1-yl]-3-(2,5-dimethoxyphenyl)prop-2-en-1-one Traditional Name: 1-[2-(2-chloronicotinoyl)pyrazolidin-1-yl]-3-(2,5-dimethoxyphenyl)prop-2-en-1-one Formula: C20H20ClN3O4 MolecularWeight: 401.8435

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C=CC(=O)N2CCCN2C(=O)C3=C(N=CC=C3)Cl

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C=CC(=O)N2CCCN2C(=O)C3=C(N=CC=C3)Cl

InChI

InChI=1S/C20H20ClN3O4/c1-27-15-7-8-17(28-2)14(13-15)6-9-18(25)23-11-4-12-24(23)20(26)16-5-3-10-22-19(16)21/h3,5-10,13H,4,11-12H2,1-2H3