[(2S)-2-[4-(1,3-benzodioxol-5-yloxy)phenyl]-2-oxidanyl-ethyl]-cyclopropyl-azanium

Systemtic Name: [(2S)-2-[4-(1,3-benzodioxol-5-yloxy)phenyl]-2-oxidanyl-ethyl]-cyclopropyl-azanium Openeye Name: [(2S)-2-[4-(1,3-benzodioxol-5-yloxy)phenyl]-2-hydroxy-ethyl]-cyclopropyl-ammonium CAS Name: [(2S)-2-[4-(1,3-benzodioxol-5-yloxy)phenyl]-2-hydroxyethyl]-cyclopropylammonium IUPAC Name: [(2S)-2-[4-(1,3-benzodioxol-5-yloxy)phenyl]-2-hydroxyethyl]-cyclopropylazanium Traditional Name: [(2S)-2-[4-(1,3-benzodioxol-5-yloxy)phenyl]-2-hydroxy-ethyl]-cyclopropyl-ammonium Formula: C18H20NO4+ MolecularWeight: 314.3557

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1[NH2+]CC(C2=CC=C(C=C2)OC3=CC4=C(C=C3)OCO4)O

Isomeric SMILES

C1CC1[NH2+]C[C@H](C2=CC=C(C=C2)OC3=CC4=C(C=C3)OCO4)O

InChI

InChI=1S/C18H19NO4/c20-16(10-19-13-3-4-13)12-1-5-14(6-2-12)23-15-7-8-17-18(9-15)22-11-21-17/h1-2,5-9,13,16,19-20H,3-4,10-11H2/p+1/t16-/m1/s1