(E)-N-(3-ethynylphenyl)-3-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]prop-2-enamide

Systemtic Name: (E)-N-(3-ethynylphenyl)-3-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]prop-2-enamide Openeye Name: (E)-N-(3-ethynylphenyl)-3-[4-(2-oxopyrrolidin-1-yl)phenyl]prop-2-enamide CAS Name: (E)-N-(3-ethynylphenyl)-3-[4-(2-oxo-1-pyrrolidinyl)phenyl]-2-propenamide IUPAC Name: (E)-N-(3-ethynylphenyl)-3-[4-(2-oxopyrrolidin-1-yl)phenyl]prop-2-enamide Traditional Name: (E)-N-(3-ethynylphenyl)-3-[4-(2-ketopyrrolidino)phenyl]acrylamide Formula: C21H18N2O2 MolecularWeight: 330.37982

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NC(=O)C=CC2=CC=C(C=C2)N3CCCC3=O

Isomeric SMILES

C#CC1=CC(=CC=C1)NC(=O)/C=C/C2=CC=C(C=C2)N3CCCC3=O

InChI

InChI=1S/C21H18N2O2/c1-2-16-5-3-6-18(15-16)22-20(24)13-10-17-8-11-19(12-9-17)23-14-4-7-21(23)25/h1,3,5-6,8-13,15H,4,7,14H2,(H,22,24)/b13-10+