(3-methoxyphenyl)methyl-(phenylmethyl)-[(5-piperidin-1-ylcarbonylfuran-2-yl)methyl]azanium

Systemtic Name: (3-methoxyphenyl)methyl-(phenylmethyl)-[(5-piperidin-1-ylcarbonylfuran-2-yl)methyl]azanium Openeye Name: benzyl-[(3-methoxyphenyl)methyl]-[[5-(piperidine-1-carbonyl)-2-furyl]methyl]ammonium CAS Name: (3-methoxyphenyl)methyl-[[5-[oxo(1-piperidinyl)methyl]-2-furanyl]methyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-[(3-methoxyphenyl)methyl]-[[5-(piperidine-1-carbonyl)furan-2-yl]methyl]azanium Traditional Name: benzyl-m-anisyl-[[5-(piperidine-1-carbonyl)-2-furyl]methyl]ammonium Formula: C26H31N2O3+ MolecularWeight: 419.53594

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C[NH+](CC2=CC=CC=C2)CC3=CC=C(O3)C(=O)N4CCCCC4

Isomeric SMILES

COC1=CC=CC(=C1)C[NH+](CC2=CC=CC=C2)CC3=CC=C(O3)C(=O)N4CCCCC4

InChI

InChI=1S/C26H30N2O3/c1-30-23-12-8-11-22(17-23)19-27(18-21-9-4-2-5-10-21)20-24-13-14-25(31-24)26(29)28-15-6-3-7-16-28/h2,4-5,8-14,17H,3,6-7,15-16,18-20H2,1H3/p+1