(5R)-5-thiophen-2-yl-2,3,4,5-tetrahydro-1,4-benzoxazepin-4-ium

Systemtic Name: (5R)-5-thiophen-2-yl-2,3,4,5-tetrahydro-1,4-benzoxazepin-4-ium Openeye Name: (5R)-5-(2-thienyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-4-ium CAS Name: (5R)-5-thiophen-2-yl-2,3,4,5-tetrahydro-1,4-benzoxazepin-4-ium IUPAC Name: (5R)-5-thiophen-2-yl-2,3,4,5-tetrahydro-1,4-benzoxazepin-4-ium Traditional Name: (5R)-5-(2-thienyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-4-ium Formula: C13H14NOS+ MolecularWeight: 232.32136

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC=C2C([NH2+]1)C3=CC=CS3

Isomeric SMILES

C1COC2=CC=CC=C2[C@@H]([NH2+]1)C3=CC=CS3

InChI

InChI=1S/C13H13NOS/c1-2-5-11-10(4-1)13(14-7-8-15-11)12-6-3-9-16-12/h1-6,9,13-14H,7-8H2/p+1/t13-/m1/s1