[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-(4-pyrrol-1-ylphenyl)methanone

Systemtic Name: [4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-(4-pyrrol-1-ylphenyl)methanone Openeye Name: [4-(2,3-dihydrobenzofuran-5-ylmethyl)piperazin-1-yl]-(4-pyrrol-1-ylphenyl)methanone CAS Name: [4-(2,3-dihydrobenzofuran-5-ylmethyl)-1-piperazinyl]-[4-(1-pyrrolyl)phenyl]methanone IUPAC Name: [4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-(4-pyrrol-1-ylphenyl)methanone Traditional Name: [4-(coumaran-5-ylmethyl)piperazino]-(4-pyrrol-1-ylphenyl)methanone Formula: C24H25N3O2 MolecularWeight: 387.4742

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=C(C=C2)CN3CCN(CC3)C(=O)C4=CC=C(C=C4)N5C=CC=C5

Isomeric SMILES

C1COC2=C1C=C(C=C2)CN3CCN(CC3)C(=O)C4=CC=C(C=C4)N5C=CC=C5

InChI

InChI=1S/C24H25N3O2/c28-24(20-4-6-22(7-5-20)26-10-1-2-11-26)27-14-12-25(13-15-27)18-19-3-8-23-21(17-19)9-16-29-23/h1-8,10-11,17H,9,12-16,18H2