(N,N'-dicyclohexylcarbamimidoyl) 2-phenylethanoate

Systemtic Name: (N,N'-dicyclohexylcarbamimidoyl) 2-phenylethanoate Openeye Name: (N,N'-dicyclohexylcarbamimidoyl) 2-phenylacetate CAS Name: 2-phenylacetic acid [(cyclohexylamino)-cyclohexyliminomethyl] ester IUPAC Name: (N,N'-dicyclohexylcarbamimidoyl) 2-phenylacetate Traditional Name: 2-phenylacetic acid (N,N'-dicyclohexylamidino) ester Formula: C21H30N2O2 MolecularWeight: 342.4751

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H30N2O2/c24-20(16-17-10-4-1-5-11-17)25-21(22-18-12-6-2-7-13-18)23-19-14-8-3-9-15-19/h1,4-5,10-11,18-19H,2-3,6-9,12-16H2,(H,22,23)