N-(9,11-dihydropyrrolo[2,1-c][1,4]benzoxazepin-10-ium-10-ylmethyl)propan-1-amine

Systemtic Name: N-(9,11-dihydropyrrolo[2,1-c][1,4]benzoxazepin-10-ium-10-ylmethyl)propan-1-amine Openeye Name: N-(9,11-dihydropyrrolo[2,1-c][1,4]benzoxazepin-10-ium-10-ylmethyl)propan-1-amine CAS Name: N-(9,11-dihydropyrrolo[2,1-c][1,4]benzoxazepin-10-ium-10-ylmethyl)-1-propanamine IUPAC Name: N-(9,11-dihydropyrrolo[2,1-c][1,4]benzoxazepin-10-ium-10-ylmethyl)propan-1-amine Traditional Name: 9,11-dihydropyrrolo[2,1-c][1,4]benzoxazepin-10-ium-10-ylmethyl(propyl)amine Formula: C16H21N2O+ MolecularWeight: 257.35074

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC[N+]12CC=CC1=COC3=CC=CC=C3C2

Isomeric SMILES

CCCNC[N+]12CC=CC1=COC3=CC=CC=C3C2

InChI

InChI=1S/C16H21N2O/c1-2-9-17-13-18-10-5-7-15(18)12-19-16-8-4-3-6-14(16)11-18/h3-8,12,17H,2,9-11,13H2,1H3/q+1