2-diethylaminoethyl (2E)-2-(phenylmethylidene)heptanoate

Systemtic Name: 2-diethylaminoethyl (2E)-2-(phenylmethylidene)heptanoate Openeye Name: 2-diethylaminoethyl (2E)-2-benzylideneheptanoate CAS Name: (2E)-2-(phenylmethylene)heptanoic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl (2E)-2-benzylideneheptanoate Traditional Name: (E)-2-amyl-3-phenyl-acrylic acid 2-diethylaminoethyl ester Formula: C20H31NO2 MolecularWeight: 317.46564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=CC1=CC=CC=C1)C(=O)OCCN(CC)CC

Isomeric SMILES

CCCCC/C(=C\C1=CC=CC=C1)/C(=O)OCCN(CC)CC

InChI

InChI=1S/C20H31NO2/c1-4-7-9-14-19(17-18-12-10-8-11-13-18)20(22)23-16-15-21(5-2)6-3/h8,10-13,17H,4-7,9,14-16H2,1-3H3/b19-17+