(1E)-1-(3-methyl-1-phenyl-pyrrolidin-2-ylidene)pentan-2-one

Systemtic Name: (1E)-1-(3-methyl-1-phenyl-pyrrolidin-2-ylidene)pentan-2-one Openeye Name: (1E)-1-(3-methyl-1-phenyl-pyrrolidin-2-ylidene)pentan-2-one CAS Name: (1E)-1-(3-methyl-1-phenyl-2-pyrrolidinylidene)-2-pentanone IUPAC Name: (1E)-1-(3-methyl-1-phenylpyrrolidin-2-ylidene)pentan-2-one Traditional Name: (1E)-1-(3-methyl-1-phenyl-pyrrolidin-2-ylidene)pentan-2-one Formula: C16H21NO MolecularWeight: 243.34404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C=C1C(CCN1C2=CC=CC=C2)C

Isomeric SMILES

CCCC(=O)/C=C/1\C(CCN1C2=CC=CC=C2)C

InChI

InChI=1S/C16H21NO/c1-3-7-15(18)12-16-13(2)10-11-17(16)14-8-5-4-6-9-14/h4-6,8-9,12-13H,3,7,10-11H2,1-2H3/b16-12+