[(2R)-3-(1,3-benzodioxol-5-ylmethoxy)-2-oxidanyl-propyl]-(furan-2-ylmethyl)azanium

Systemtic Name: [(2R)-3-(1,3-benzodioxol-5-ylmethoxy)-2-oxidanyl-propyl]-(furan-2-ylmethyl)azanium Openeye Name: [(2R)-3-(1,3-benzodioxol-5-ylmethoxy)-2-hydroxy-propyl]-(2-furylmethyl)ammonium CAS Name: [(2R)-3-(1,3-benzodioxol-5-ylmethoxy)-2-hydroxypropyl]-(2-furanylmethyl)ammonium IUPAC Name: [(2R)-3-(1,3-benzodioxol-5-ylmethoxy)-2-hydroxypropyl]-(furan-2-ylmethyl)azanium Traditional Name: 2-furfuryl-[(2R)-2-hydroxy-3-piperonyloxy-propyl]ammonium Formula: C16H20NO5+ MolecularWeight: 306.3337

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)COCC(C[NH2+]CC3=CC=CO3)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)COC[C@@H](C[NH2+]CC3=CC=CO3)O

InChI

InChI=1S/C16H19NO5/c18-13(7-17-8-14-2-1-5-20-14)10-19-9-12-3-4-15-16(6-12)22-11-21-15/h1-6,13,17-18H,7-11H2/p+1/t13-/m1/s1