2-chloranyl-4-[3,5-dimethyl-4-(4-morpholin-4-ylcarbonylphenoxy)pyrazol-1-yl]benzenecarbonitrile

Systemtic Name: 2-chloranyl-4-[3,5-dimethyl-4-(4-morpholin-4-ylcarbonylphenoxy)pyrazol-1-yl]benzenecarbonitrile Openeye Name: 2-chloro-4-[3,5-dimethyl-4-[4-(morpholine-4-carbonyl)phenoxy]pyrazol-1-yl]benzonitrile CAS Name: 2-chloro-4-[3,5-dimethyl-4-[4-[4-morpholinyl(oxo)methyl]phenoxy]-1-pyrazolyl]benzonitrile IUPAC Name: 2-chloro-4-[3,5-dimethyl-4-[4-(morpholine-4-carbonyl)phenoxy]pyrazol-1-yl]benzonitrile Traditional Name: 2-chloro-4-[3,5-dimethyl-4-[4-(morpholine-4-carbonyl)phenoxy]pyrazol-1-yl]benzonitrile Formula: C23H21ClN4O3 MolecularWeight: 436.89084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC(=C(C=C2)C#N)Cl)C)OC3=CC=C(C=C3)C(=O)N4CCOCC4

Isomeric SMILES

CC1=C(C(=NN1C2=CC(=C(C=C2)C#N)Cl)C)OC3=CC=C(C=C3)C(=O)N4CCOCC4

InChI

InChI=1S/C23H21ClN4O3/c1-15-22(16(2)28(26-15)19-6-3-18(14-25)21(24)13-19)31-20-7-4-17(5-8-20)23(29)27-9-11-30-12-10-27/h3-8,13H,9-12H2,1-2H3