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

Systemtic Name: N-(9,11-dihydropyrrolo[2,1-c][1,4]benzoxazepin-10-ium-10-ylmethyl)-N-ethyl-ethanamine Openeye Name: N-(9,11-dihydropyrrolo[2,1-c][1,4]benzoxazepin-10-ium-10-ylmethyl)-N-ethyl-ethanamine CAS Name: N-(9,11-dihydropyrrolo[2,1-c][1,4]benzoxazepin-10-ium-10-ylmethyl)-N-ethylethanamine IUPAC Name: N-(9,11-dihydropyrrolo[2,1-c][1,4]benzoxazepin-10-ium-10-ylmethyl)-N-ethylethanamine Traditional Name: 9,11-dihydropyrrolo[2,1-c][1,4]benzoxazepin-10-ium-10-ylmethyl(diethyl)amine Formula: C17H23N2O+ MolecularWeight: 271.37732

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C[N+]12CC=CC1=COC3=CC=CC=C3C2

Isomeric SMILES

CCN(CC)C[N+]12CC=CC1=COC3=CC=CC=C3C2

InChI

InChI=1S/C17H23N2O/c1-3-18(4-2)14-19-11-7-9-16(19)13-20-17-10-6-5-8-15(17)12-19/h5-10,13H,3-4,11-12,14H2,1-2H3/q+1