N-ethyl-2,4,6,7-tetramethyl-2-[(4-phenylpiperazin-1-yl)methyl]-3H-1-benzofuran-5-amine trihydrochloride

Systemtic Name: N-ethyl-2,4,6,7-tetramethyl-2-[(4-phenylpiperazin-1-yl)methyl]-3H-1-benzofuran-5-amine trihydrochloride Openeye Name: N-ethyl-2,4,6,7-tetramethyl-2-[(4-phenylpiperazin-1-yl)methyl]-3H-benzofuran-5-amine trihydrochloride CAS Name: N-ethyl-2,4,6,7-tetramethyl-2-[(4-phenyl-1-piperazinyl)methyl]-3H-benzofuran-5-amine trihydrochloride IUPAC Name: N-ethyl-2,4,6,7-tetramethyl-2-[(4-phenylpiperazin-1-yl)methyl]-3H-1-benzofuran-5-amine trihydrochloride Traditional Name: ethyl-[2,4,6,7-tetramethyl-2-[(4-phenylpiperazino)methyl]coumaran-5-yl]amine trihydrochloride Formula: C25H38Cl3N3O MolecularWeight: 502.94772

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C(=C2C(=C1C)CC(O2)(C)CN3CCN(CC3)C4=CC=CC=C4)C)C.Cl.Cl.Cl

Isomeric SMILES

CCNC1=C(C(=C2C(=C1C)CC(O2)(C)CN3CCN(CC3)C4=CC=CC=C4)C)C.Cl.Cl.Cl

InChI

InChI=1S/C25H35N3O.3ClH/c1-6-26-23-18(2)19(3)24-22(20(23)4)16-25(5,29-24)17-27-12-14-28(15-13-27)21-10-8-7-9-11-21;;;/h7-11,26H,6,12-17H2,1-5H3;3*1H