ethyl 4-(3-bromanyl-4-ethoxy-5-methoxy-phenyl)carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-(3-bromanyl-4-ethoxy-5-methoxy-phenyl)carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-(3-bromo-4-ethoxy-5-methoxy-benzoyl)piperazine-1-carboxylate CAS Name: 4-[(3-bromo-4-ethoxy-5-methoxyphenyl)-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-bromo-4-ethoxy-5-methoxybenzoyl)piperazine-1-carboxylate Traditional Name: 4-(3-bromo-4-ethoxy-5-methoxy-benzoyl)piperazine-1-carboxylic acid ethyl ester Formula: C17H23BrN2O5 MolecularWeight: 415.27892

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)C(=O)N2CCN(CC2)C(=O)OCC)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)C(=O)N2CCN(CC2)C(=O)OCC)OC

InChI

InChI=1S/C17H23BrN2O5/c1-4-24-15-13(18)10-12(11-14(15)23-3)16(21)19-6-8-20(9-7-19)17(22)25-5-2/h10-11H,4-9H2,1-3H3