(N,N'-dicyclohexylcarbamimidoyl) (E)-3-phenylprop-2-enoate

Systemtic Name: (N,N'-dicyclohexylcarbamimidoyl) (E)-3-phenylprop-2-enoate Openeye Name: (N,N'-dicyclohexylcarbamimidoyl) (E)-3-phenylprop-2-enoate CAS Name: (E)-3-phenyl-2-propenoic acid [(cyclohexylamino)-cyclohexyliminomethyl] ester IUPAC Name: (N,N'-dicyclohexylcarbamimidoyl) (E)-3-phenylprop-2-enoate Traditional Name: (E)-3-phenylacrylic acid (N,N'-dicyclohexylamidino) ester Formula: C22H30N2O2 MolecularWeight: 354.4858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=NC2CCCCC2)OC(=O)C=CC3=CC=CC=C3

Isomeric SMILES

C1CCC(CC1)NC(=NC2CCCCC2)OC(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C22H30N2O2/c25-21(17-16-18-10-4-1-5-11-18)26-22(23-19-12-6-2-7-13-19)24-20-14-8-3-9-15-20/h1,4-5,10-11,16-17,19-20H,2-3,6-9,12-15H2,(H,23,24)/b17-16+