5-methoxy-N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]-2,3-dihydro-1,4-benzodioxine-7-carboxamide

Systemtic Name: 5-methoxy-N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]-2,3-dihydro-1,4-benzodioxine-7-carboxamide Openeye Name: 5-methoxy-N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]-2,3-dihydro-1,4-benzodioxine-7-carboxamide CAS Name: 5-methoxy-N-[(2R)-2-phenyl-2-(1-pyrrolidin-1-iumyl)ethyl]-2,3-dihydro-1,4-benzodioxin-7-carboxamide IUPAC Name: 5-methoxy-N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-ylethyl]-2,3-dihydro-1,4-benzodioxine-7-carboxamide Traditional Name: 5-methoxy-N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]-2,3-dihydro-1,4-benzodioxin-7-carboxamide Formula: C22H27N2O4+ MolecularWeight: 383.46078

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1OCCO2)C(=O)NCC(C3=CC=CC=C3)[NH+]4CCCC4

Isomeric SMILES

COC1=CC(=CC2=C1OCCO2)C(=O)NC[C@@H](C3=CC=CC=C3)[NH+]4CCCC4

InChI

InChI=1S/C22H26N2O4/c1-26-19-13-17(14-20-21(19)28-12-11-27-20)22(25)23-15-18(24-9-5-6-10-24)16-7-3-2-4-8-16/h2-4,7-8,13-14,18H,5-6,9-12,15H2,1H3,(H,23,25)/p+1/t18-/m0/s1