(5-ethoxycarbonylfuran-2-yl)methyl-[1-[4-(2-phenoxyethanoylamino)phenyl]piperidin-4-yl]azanium

Systemtic Name: (5-ethoxycarbonylfuran-2-yl)methyl-[1-[4-(2-phenoxyethanoylamino)phenyl]piperidin-4-yl]azanium Openeye Name: (5-ethoxycarbonyl-2-furyl)methyl-[1-[4-[(2-phenoxyacetyl)amino]phenyl]-4-piperidyl]ammonium CAS Name: (5-ethoxycarbonyl-2-furanyl)methyl-[1-[4-[(1-oxo-2-phenoxyethyl)amino]phenyl]-4-piperidinyl]ammonium IUPAC Name: (5-ethoxycarbonylfuran-2-yl)methyl-[1-[4-[(2-phenoxyacetyl)amino]phenyl]piperidin-4-yl]azanium Traditional Name: (5-carbethoxy-2-furyl)methyl-[1-[4-[(2-phenoxyacetyl)amino]phenyl]-4-piperidyl]ammonium Formula: C27H32N3O5+ MolecularWeight: 478.56008

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(O1)C[NH2+]C2CCN(CC2)C3=CC=C(C=C3)NC(=O)COC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(O1)C[NH2+]C2CCN(CC2)C3=CC=C(C=C3)NC(=O)COC4=CC=CC=C4

InChI

InChI=1S/C27H31N3O5/c1-2-33-27(32)25-13-12-24(35-25)18-28-20-14-16-30(17-15-20)22-10-8-21(9-11-22)29-26(31)19-34-23-6-4-3-5-7-23/h3-13,20,28H,2,14-19H2,1H3,(H,29,31)/p+1