methyl (E)-3-[4-[(2-quinolin-3-ylethylamino)methyl]phenyl]prop-2-enoate

Systemtic Name: methyl (E)-3-[4-[(2-quinolin-3-ylethylamino)methyl]phenyl]prop-2-enoate Openeye Name: methyl (E)-3-[4-[[2-(3-quinolyl)ethylamino]methyl]phenyl]prop-2-enoate CAS Name: (E)-3-[4-[[2-(3-quinolinyl)ethylamino]methyl]phenyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[4-[(2-quinolin-3-ylethylamino)methyl]phenyl]prop-2-enoate Traditional Name: (E)-3-[4-[[2-(3-quinolyl)ethylamino]methyl]phenyl]acrylic acid methyl ester Formula: C22H22N2O2 MolecularWeight: 346.42228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CC1=CC=C(C=C1)CNCCC2=CC3=CC=CC=C3N=C2

Isomeric SMILES

COC(=O)/C=C/C1=CC=C(C=C1)CNCCC2=CC3=CC=CC=C3N=C2

InChI

InChI=1S/C22H22N2O2/c1-26-22(25)11-10-17-6-8-18(9-7-17)15-23-13-12-19-14-20-4-2-3-5-21(20)24-16-19/h2-11,14,16,23H,12-13,15H2,1H3/b11-10+