[4-(4-pyridin-2-ylbut-3-ynylamino)phenyl] pent-2-ynoate

Systemtic Name: [4-(4-pyridin-2-ylbut-3-ynylamino)phenyl] pent-2-ynoate Openeye Name: [4-[4-(2-pyridyl)but-3-ynylamino]phenyl] pent-2-ynoate CAS Name: 2-pentynoic acid [4-[4-(2-pyridinyl)but-3-ynylamino]phenyl] ester IUPAC Name: [4-(4-pyridin-2-ylbut-3-ynylamino)phenyl] pent-2-ynoate Traditional Name: pent-2-ynoic acid [4-[4-(2-pyridyl)but-3-ynylamino]phenyl] ester Formula: C20H18N2O2 MolecularWeight: 318.36912

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Descriptors Computed from Structure

Canonical SMILES:

CCC#CC(=O)OC1=CC=C(C=C1)NCCC#CC2=CC=CC=N2

Isomeric SMILES

CCC#CC(=O)OC1=CC=C(C=C1)NCCC#CC2=CC=CC=N2

InChI

InChI=1S/C20H18N2O2/c1-2-3-10-20(23)24-19-13-11-18(12-14-19)22-16-7-5-9-17-8-4-6-15-21-17/h4,6,8,11-15,22H,2,7,16H2,1H3