(E)-1-(3,5-dimethylphenyl)-3-[2-ethyl-4-(2-pyrrolidin-1-ylethoxy)phenyl]prop-2-en-1-one

Systemtic Name: (E)-1-(3,5-dimethylphenyl)-3-[2-ethyl-4-(2-pyrrolidin-1-ylethoxy)phenyl]prop-2-en-1-one Openeye Name: (E)-1-(3,5-dimethylphenyl)-3-[2-ethyl-4-(2-pyrrolidin-1-ylethoxy)phenyl]prop-2-en-1-one CAS Name: (E)-1-(3,5-dimethylphenyl)-3-[2-ethyl-4-[2-(1-pyrrolidinyl)ethoxy]phenyl]-2-propen-1-one IUPAC Name: (E)-1-(3,5-dimethylphenyl)-3-[2-ethyl-4-(2-pyrrolidin-1-ylethoxy)phenyl]prop-2-en-1-one Traditional Name: (E)-1-(3,5-dimethylphenyl)-3-[2-ethyl-4-(2-pyrrolidinoethoxy)phenyl]prop-2-en-1-one Formula: C25H31NO2 MolecularWeight: 377.51914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)OCCN2CCCC2)C=CC(=O)C3=CC(=CC(=C3)C)C

Isomeric SMILES

CCC1=C(C=CC(=C1)OCCN2CCCC2)/C=C/C(=O)C3=CC(=CC(=C3)C)C

InChI

InChI=1S/C25H31NO2/c1-4-21-18-24(28-14-13-26-11-5-6-12-26)9-7-22(21)8-10-25(27)23-16-19(2)15-20(3)17-23/h7-10,15-18H,4-6,11-14H2,1-3H3/b10-8+