(7-azanyl-2-methyl-1-benzofuran-3-yl)-[4-[3-(dibutylamino)propoxy]phenyl]methanone dihydrochloride

Systemtic Name: (7-azanyl-2-methyl-1-benzofuran-3-yl)-[4-[3-(dibutylamino)propoxy]phenyl]methanone dihydrochloride Openeye Name: (7-amino-2-methyl-benzofuran-3-yl)-[4-[3-(dibutylamino)propoxy]phenyl]methanone dihydrochloride CAS Name: (7-amino-2-methyl-3-benzofuranyl)-[4-[3-(dibutylamino)propoxy]phenyl]methanone dihydrochloride IUPAC Name: (7-amino-2-methyl-1-benzofuran-3-yl)-[4-[3-(dibutylamino)propoxy]phenyl]methanone dihydrochloride Traditional Name: (7-amino-2-methyl-benzofuran-3-yl)-[4-[3-(dibutylamino)propoxy]phenyl]methanone dihydrochloride Formula: C27H38Cl2N2O3 MolecularWeight: 509.50822

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CCCOC1=CC=C(C=C1)C(=O)C2=C(OC3=C2C=CC=C3N)C.Cl.Cl

Isomeric SMILES

CCCCN(CCCC)CCCOC1=CC=C(C=C1)C(=O)C2=C(OC3=C2C=CC=C3N)C.Cl.Cl

InChI

InChI=1S/C27H36N2O3.2ClH/c1-4-6-16-29(17-7-5-2)18-9-19-31-22-14-12-21(13-15-22)26(30)25-20(3)32-27-23(25)10-8-11-24(27)28;;/h8,10-15H,4-7,9,16-19,28H2,1-3H3;2*1H