(3-bromanyl-5-methoxy-4-propoxy-phenyl)-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]methanone

Systemtic Name: (3-bromanyl-5-methoxy-4-propoxy-phenyl)-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]methanone Openeye Name: (3-bromo-5-methoxy-4-propoxy-phenyl)-[4-(2,3-dihydrobenzofuran-5-ylmethyl)piperazin-1-yl]methanone CAS Name: (3-bromo-5-methoxy-4-propoxyphenyl)-[4-(2,3-dihydrobenzofuran-5-ylmethyl)-1-piperazinyl]methanone IUPAC Name: (3-bromo-5-methoxy-4-propoxyphenyl)-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]methanone Traditional Name: (3-bromo-5-methoxy-4-propoxy-phenyl)-[4-(coumaran-5-ylmethyl)piperazino]methanone Formula: C24H29BrN2O4 MolecularWeight: 489.40206

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Br)C(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCC4)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Br)C(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCC4)OC

InChI

InChI=1S/C24H29BrN2O4/c1-3-11-31-23-20(25)14-19(15-22(23)29-2)24(28)27-9-7-26(8-10-27)16-17-4-5-21-18(13-17)6-12-30-21/h4-5,13-15H,3,6-12,16H2,1-2H3