ethyl 5-[[(3-bromophenyl)-phenylmethoxy-methyl]-ethyl-amino]pyrazine-2-carboxylate

Systemtic Name: ethyl 5-[[(3-bromophenyl)-phenylmethoxy-methyl]-ethyl-amino]pyrazine-2-carboxylate Openeye Name: ethyl 5-[[benzyloxy-(3-bromophenyl)methyl]-ethyl-amino]pyrazine-2-carboxylate CAS Name: 5-[[(3-bromophenyl)-phenylmethoxymethyl]-ethylamino]-2-pyrazinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[(3-bromophenyl)-phenylmethoxymethyl]-ethylamino]pyrazine-2-carboxylate Traditional Name: 5-[[benzoxy-(3-bromophenyl)methyl]-ethyl-amino]pyrazinic acid ethyl ester Formula: C23H24BrN3O3 MolecularWeight: 470.35896

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=NC=C(N=C1)C(=O)OCC)C(C2=CC(=CC=C2)Br)OCC3=CC=CC=C3

Isomeric SMILES

CCN(C1=NC=C(N=C1)C(=O)OCC)C(C2=CC(=CC=C2)Br)OCC3=CC=CC=C3

InChI

InChI=1S/C23H24BrN3O3/c1-3-27(21-15-25-20(14-26-21)23(28)29-4-2)22(18-11-8-12-19(24)13-18)30-16-17-9-6-5-7-10-17/h5-15,22H,3-4,16H2,1-2H3