bromanylmethane; [2-(4-methylpiperazin-1-yl)-2-phenyl-ethyl] 2,2-diphenylethanoate

Systemtic Name: bromanylmethane; [2-(4-methylpiperazin-1-yl)-2-phenyl-ethyl] 2,2-diphenylethanoate Openeye Name: bromomethane; [2-(4-methylpiperazin-1-yl)-2-phenyl-ethyl] 2,2-diphenylacetate CAS Name: bromomethane; 2,2-diphenylacetic acid [2-(4-methyl-1-piperazinyl)-2-phenylethyl] ester IUPAC Name: bromomethane; [2-(4-methylpiperazin-1-yl)-2-phenylethyl] 2,2-diphenylacetate Traditional Name: bromomethane; 2,2-diphenylacetic acid [2-(4-methylpiperazino)-2-phenyl-ethyl] ester Formula: C28H33BrN2O2 MolecularWeight: 509.47782

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(COC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.CBr

Isomeric SMILES

CN1CCN(CC1)C(COC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.CBr

InChI

InChI=1S/C27H30N2O2.CH3Br/c1-28-17-19-29(20-18-28)25(22-11-5-2-6-12-22)21-31-27(30)26(23-13-7-3-8-14-23)24-15-9-4-10-16-24;1-2/h2-16,25-26H,17-21H2,1H3;1H3