3-[[4-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxymethyl]phenyl]carbonylamino]propyl-diethyl-azanium

Systemtic Name: 3-[[4-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxymethyl]phenyl]carbonylamino]propyl-diethyl-azanium Openeye Name: 3-[[4-[(2,2-dimethyl-3H-benzofuran-7-yl)oxymethyl]benzoyl]amino]propyl-diethyl-ammonium CAS Name: 3-[[[4-[(2,2-dimethyl-3H-benzofuran-7-yl)oxymethyl]phenyl]-oxomethyl]amino]propyl-diethylammonium IUPAC Name: 3-[[4-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxymethyl]benzoyl]amino]propyl-diethylazanium Traditional Name: 3-[[4-[(2,2-dimethylcoumaran-7-yl)oxymethyl]benzoyl]amino]propyl-diethyl-ammonium Formula: C25H35N2O3+ MolecularWeight: 411.557

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCNC(=O)C1=CC=C(C=C1)COC2=CC=CC3=C2OC(C3)(C)C

Isomeric SMILES

CC[NH+](CC)CCCNC(=O)C1=CC=C(C=C1)COC2=CC=CC3=C2OC(C3)(C)C

InChI

InChI=1S/C25H34N2O3/c1-5-27(6-2)16-8-15-26-24(28)20-13-11-19(12-14-20)18-29-22-10-7-9-21-17-25(3,4)30-23(21)22/h7,9-14H,5-6,8,15-18H2,1-4H3,(H,26,28)/p+1