6-(azepan-1-ium-1-ylmethyl)-3,4-dihydro-2H-1,4-benzoxazine

Systemtic Name: 6-(azepan-1-ium-1-ylmethyl)-3,4-dihydro-2H-1,4-benzoxazine Openeye Name: 6-(azepan-1-ium-1-ylmethyl)-3,4-dihydro-2H-1,4-benzoxazine CAS Name: 6-(1-azepan-1-iumylmethyl)-3,4-dihydro-2H-1,4-benzoxazine IUPAC Name: 6-(azepan-1-ium-1-ylmethyl)-3,4-dihydro-2H-1,4-benzoxazine Traditional Name: 6-(azepan-1-ium-1-ylmethyl)-3,4-dihydro-2H-1,4-benzoxazine Formula: C15H23N2O+ MolecularWeight: 247.35592

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)CC2=CC3=C(C=C2)OCCN3

Isomeric SMILES

C1CCC[NH+](CC1)CC2=CC3=C(C=C2)OCCN3

InChI

InChI=1S/C15H22N2O/c1-2-4-9-17(8-3-1)12-13-5-6-15-14(11-13)16-7-10-18-15/h5-6,11,16H,1-4,7-10,12H2/p+1