methyl (E)-3-[1,4-bis(phenylmethyl)piperazin-2-yl]prop-2-enoate

Systemtic Name: methyl (E)-3-[1,4-bis(phenylmethyl)piperazin-2-yl]prop-2-enoate Openeye Name: methyl (E)-3-(1,4-dibenzylpiperazin-2-yl)prop-2-enoate CAS Name: (E)-3-[1,4-bis(phenylmethyl)-2-piperazinyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-(1,4-dibenzylpiperazin-2-yl)prop-2-enoate Traditional Name: (E)-3-(1,4-dibenzylpiperazin-2-yl)acrylic acid methyl ester Formula: C22H26N2O2 MolecularWeight: 350.45404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CC1CN(CCN1CC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

COC(=O)/C=C/C1CN(CCN1CC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C22H26N2O2/c1-26-22(25)13-12-21-18-23(16-19-8-4-2-5-9-19)14-15-24(21)17-20-10-6-3-7-11-20/h2-13,21H,14-18H2,1H3/b13-12+