4-[2-[[3,5-bis(bromanyl)phenyl]methoxy]-5-methoxy-2,3-dihydro-1H-inden-1-yl]piperazine-1-carboxylate

Systemtic Name: 4-[2-[[3,5-bis(bromanyl)phenyl]methoxy]-5-methoxy-2,3-dihydro-1H-inden-1-yl]piperazine-1-carboxylate Openeye Name: 4-[2-[(3,5-dibromophenyl)methoxy]-5-methoxy-indan-1-yl]piperazine-1-carboxylate CAS Name: 4-[2-[(3,5-dibromophenyl)methoxy]-5-methoxy-2,3-dihydro-1H-inden-1-yl]-1-piperazinecarboxylate IUPAC Name: 4-[2-[(3,5-dibromophenyl)methoxy]-5-methoxy-2,3-dihydro-1H-inden-1-yl]piperazine-1-carboxylate Traditional Name: 4-[2-(3,5-dibromobenzyl)oxy-5-methoxy-indan-1-yl]piperazine-1-carboxylate Formula: C22H23Br2N2O4- MolecularWeight: 539.23702

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(C(C2)OCC3=CC(=CC(=C3)Br)Br)N4CCN(CC4)C(=O)[O-]

Isomeric SMILES

COC1=CC2=C(C=C1)C(C(C2)OCC3=CC(=CC(=C3)Br)Br)N4CCN(CC4)C(=O)[O-]

InChI

InChI=1S/C22H24Br2N2O4/c1-29-18-2-3-19-15(10-18)11-20(30-13-14-8-16(23)12-17(24)9-14)21(19)25-4-6-26(7-5-25)22(27)28/h2-3,8-10,12,20-21H,4-7,11,13H2,1H3,(H,27,28)/p-1