carboxy-diethyl-[2-(1-methylpiperidin-4-yl)-1-benzofuran-7-yl]azanium

Systemtic Name: carboxy-diethyl-[2-(1-methylpiperidin-4-yl)-1-benzofuran-7-yl]azanium Openeye Name: carboxy-diethyl-[2-(1-methyl-4-piperidyl)benzofuran-7-yl]ammonium CAS Name: carboxy-diethyl-[2-(1-methyl-4-piperidinyl)-7-benzofuranyl]ammonium IUPAC Name: carboxy-diethyl-[2-(1-methylpiperidin-4-yl)-1-benzofuran-7-yl]azanium Traditional Name: carboxy-diethyl-[2-(1-methyl-4-piperidyl)benzofuran-7-yl]ammonium Formula: C19H27N2O3+ MolecularWeight: 331.42928

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(C1=CC=CC2=C1OC(=C2)C3CCN(CC3)C)C(=O)O

Isomeric SMILES

CC[N+](CC)(C1=CC=CC2=C1OC(=C2)C3CCN(CC3)C)C(=O)O

InChI

InChI=1S/C19H26N2O3/c1-4-21(5-2,19(22)23)16-8-6-7-15-13-17(24-18(15)16)14-9-11-20(3)12-10-14/h6-8,13-14H,4-5,9-12H2,1-3H3/p+1