2,4,6,7-tetramethyl-2-[[4-(4-phenylbutyl)piperazin-1-yl]methyl]-3H-1-benzofuran-5-amine

Systemtic Name: 2,4,6,7-tetramethyl-2-[[4-(4-phenylbutyl)piperazin-1-yl]methyl]-3H-1-benzofuran-5-amine Openeye Name: 2,4,6,7-tetramethyl-2-[[4-(4-phenylbutyl)piperazin-1-yl]methyl]-3H-benzofuran-5-amine CAS Name: 2,4,6,7-tetramethyl-2-[[4-(4-phenylbutyl)-1-piperazinyl]methyl]-3H-benzofuran-5-amine IUPAC Name: 2,4,6,7-tetramethyl-2-[[4-(4-phenylbutyl)piperazin-1-yl]methyl]-3H-1-benzofuran-5-amine Traditional Name: [2,4,6,7-tetramethyl-2-[[4-(4-phenylbutyl)piperazino]methyl]coumaran-5-yl]amine Formula: C27H39N3O MolecularWeight: 421.61806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2CC(OC2=C1C)(C)CN3CCN(CC3)CCCCC4=CC=CC=C4)C)N

Isomeric SMILES

CC1=C(C(=C2CC(OC2=C1C)(C)CN3CCN(CC3)CCCCC4=CC=CC=C4)C)N

InChI

InChI=1S/C27H39N3O/c1-20-21(2)26-24(22(3)25(20)28)18-27(4,31-26)19-30-16-14-29(15-17-30)13-9-8-12-23-10-6-5-7-11-23/h5-7,10-11H,8-9,12-19,28H2,1-4H3