N-methyl-N-[(5-methyl-1H-pyrazol-3-yl)methyl]-2-(2,3,4,5-tetrahydro-1,4-benzoxazepin-4-ium-4-yl)ethanamine

Systemtic Name: N-methyl-N-[(5-methyl-1H-pyrazol-3-yl)methyl]-2-(2,3,4,5-tetrahydro-1,4-benzoxazepin-4-ium-4-yl)ethanamine Openeye Name: N-methyl-N-[(5-methyl-1H-pyrazol-3-yl)methyl]-2-(2,3,4,5-tetrahydro-1,4-benzoxazepin-4-ium-4-yl)ethanamine CAS Name: N-methyl-N-[(5-methyl-1H-pyrazol-3-yl)methyl]-2-(2,3,4,5-tetrahydro-1,4-benzoxazepin-4-ium-4-yl)ethanamine IUPAC Name: N-methyl-N-[(5-methyl-1H-pyrazol-3-yl)methyl]-2-(2,3,4,5-tetrahydro-1,4-benzoxazepin-4-ium-4-yl)ethanamine Traditional Name: methyl-[(5-methyl-1H-pyrazol-3-yl)methyl]-[2-(2,3,4,5-tetrahydro-1,4-benzoxazepin-4-ium-4-yl)ethyl]amine Formula: C17H25N4O+ MolecularWeight: 301.4066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)CN(C)CC[NH+]2CCOC3=CC=CC=C3C2

Isomeric SMILES

CC1=CC(=NN1)CN(C)CC[NH+]2CCOC3=CC=CC=C3C2

InChI

InChI=1S/C17H24N4O/c1-14-11-16(19-18-14)13-20(2)7-8-21-9-10-22-17-6-4-3-5-15(17)12-21/h3-6,11H,7-10,12-13H2,1-2H3,(H,18,19)/p+1