3-[(5-methoxy-3-methyl-1-benzofuran-2-yl)carbonylamino]propyl-methyl-(phenylmethyl)azanium

Systemtic Name: 3-[(5-methoxy-3-methyl-1-benzofuran-2-yl)carbonylamino]propyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[3-[(5-methoxy-3-methyl-benzofuran-2-carbonyl)amino]propyl]-methyl-ammonium CAS Name: 3-[[(5-methoxy-3-methyl-2-benzofuranyl)-oxomethyl]amino]propyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[3-[(5-methoxy-3-methyl-1-benzofuran-2-carbonyl)amino]propyl]-methylazanium Traditional Name: benzyl-[3-[(5-methoxy-3-methyl-benzofuran-2-carbonyl)amino]propyl]-methyl-ammonium Formula: C22H27N2O3+ MolecularWeight: 367.46138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)OC)C(=O)NCCC[NH+](C)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)OC)C(=O)NCCC[NH+](C)CC3=CC=CC=C3

InChI

InChI=1S/C22H26N2O3/c1-16-19-14-18(26-3)10-11-20(19)27-21(16)22(25)23-12-7-13-24(2)15-17-8-5-4-6-9-17/h4-6,8-11,14H,7,12-13,15H2,1-3H3,(H,23,25)/p+1