(2R)-2-(azocan-1-ium-1-ylmethyl)-3,4-dihydro-2H-1,4-benzoxazine

Systemtic Name: (2R)-2-(azocan-1-ium-1-ylmethyl)-3,4-dihydro-2H-1,4-benzoxazine Openeye Name: (2R)-2-(azocan-1-ium-1-ylmethyl)-3,4-dihydro-2H-1,4-benzoxazine CAS Name: (2R)-2-(1-azocan-1-iumylmethyl)-3,4-dihydro-2H-1,4-benzoxazine IUPAC Name: (2R)-2-(azocan-1-ium-1-ylmethyl)-3,4-dihydro-2H-1,4-benzoxazine Traditional Name: (2R)-2-(azocan-1-ium-1-ylmethyl)-3,4-dihydro-2H-1,4-benzoxazine Formula: C16H25N2O+ MolecularWeight: 261.3825

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CCC1)CC2CNC3=CC=CC=C3O2

Isomeric SMILES

C1CCC[NH+](CCC1)C[C@H]2CNC3=CC=CC=C3O2

InChI

InChI=1S/C16H24N2O/c1-2-6-10-18(11-7-3-1)13-14-12-17-15-8-4-5-9-16(15)19-14/h4-5,8-9,14,17H,1-3,6-7,10-13H2/p+1/t14-/m1/s1