3-[3-[4-[(2-fluorophenyl)methoxy]phenyl]-1-phenyl-pyrazol-4-yl]-2-morpholin-4-ylcarbonyl-prop-2-enenitrile

Systemtic Name: 3-[3-[4-[(2-fluorophenyl)methoxy]phenyl]-1-phenyl-pyrazol-4-yl]-2-morpholin-4-ylcarbonyl-prop-2-enenitrile Openeye Name: 3-[3-[4-[(2-fluorophenyl)methoxy]phenyl]-1-phenyl-pyrazol-4-yl]-2-(morpholine-4-carbonyl)prop-2-enenitrile CAS Name: 3-[3-[4-[(2-fluorophenyl)methoxy]phenyl]-1-phenyl-4-pyrazolyl]-2-[4-morpholinyl(oxo)methyl]-2-propenenitrile IUPAC Name: 3-[3-[4-[(2-fluorophenyl)methoxy]phenyl]-1-phenylpyrazol-4-yl]-2-(morpholine-4-carbonyl)prop-2-enenitrile Traditional Name: 3-[3-[4-(2-fluorobenzyl)oxyphenyl]-1-phenyl-pyrazol-4-yl]-2-(morpholine-4-carbonyl)acrylonitrile Formula: C30H25FN4O3 MolecularWeight: 508.542903

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)C(=CC2=CN(N=C2C3=CC=C(C=C3)OCC4=CC=CC=C4F)C5=CC=CC=C5)C#N

Isomeric SMILES

C1COCCN1C(=O)C(=CC2=CN(N=C2C3=CC=C(C=C3)OCC4=CC=CC=C4F)C5=CC=CC=C5)C#N

InChI

InChI=1S/C30H25FN4O3/c31-28-9-5-4-6-23(28)21-38-27-12-10-22(11-13-27)29-25(20-35(33-29)26-7-2-1-3-8-26)18-24(19-32)30(36)34-14-16-37-17-15-34/h1-13,18,20H,14-17,21H2