5-[2-(3-chloranyl-2,6-dimethoxy-phenyl)carbonylpyrazolidin-1-yl]carbonylpyridine-2-carbonitrile

Systemtic Name: 5-[2-(3-chloranyl-2,6-dimethoxy-phenyl)carbonylpyrazolidin-1-yl]carbonylpyridine-2-carbonitrile Openeye Name: 5-[2-(3-chloro-2,6-dimethoxy-benzoyl)pyrazolidine-1-carbonyl]pyridine-2-carbonitrile CAS Name: 5-[[2-[(3-chloro-2,6-dimethoxyphenyl)-oxomethyl]-1-pyrazolidinyl]-oxomethyl]-2-pyridinecarbonitrile IUPAC Name: 5-[2-(3-chloro-2,6-dimethoxybenzoyl)pyrazolidine-1-carbonyl]pyridine-2-carbonitrile Traditional Name: 5-[2-(3-chloro-2,6-dimethoxy-benzoyl)pyrazolidine-1-carbonyl]picolinonitrile Formula: C19H17ClN4O4 MolecularWeight: 400.81568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17ClN4O4/c1-27-15-7-6-14(20)17(28-2)16(15)19(26)24-9-3-8-23(24)18(25)12-4-5-13(10-21)22-11-12/h4-7,11H,3,8-9H2,1-2H3