(11-methyl-6,11-dihydro-5H-benzo[b][1]benzazepin-11-ium-5-yl)-(4-methylpiperazin-4-ium-1-yl)methanone

Systemtic Name: (11-methyl-6,11-dihydro-5H-benzo[b][1]benzazepin-11-ium-5-yl)-(4-methylpiperazin-4-ium-1-yl)methanone Openeye Name: (11-methyl-6,11-dihydro-5H-benzo[b][1]benzazepin-11-ium-5-yl)-(4-methylpiperazin-4-ium-1-yl)methanone CAS Name: (11-methyl-6,11-dihydro-5H-benzo[b][1]benzazepin-11-ium-5-yl)-(4-methyl-1-piperazin-4-iumyl)methanone IUPAC Name: (11-methyl-6,11-dihydro-5H-benzo[b][1]benzazepin-11-ium-5-yl)-(4-methylpiperazin-4-ium-1-yl)methanone Traditional Name: (11-methyl-6,11-dihydro-5H-benzo[b][1]benzazepin-11-ium-5-yl)-(4-methylpiperazin-4-ium-1-yl)methanone Formula: C21H27N3O+2 MolecularWeight: 337.45858

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)C2CC3=CC=CC=C3[NH+](C4=CC=CC=C24)C

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)C2CC3=CC=CC=C3[NH+](C4=CC=CC=C24)C

InChI

InChI=1S/C21H25N3O/c1-22-11-13-24(14-12-22)21(25)18-15-16-7-3-5-9-19(16)23(2)20-10-6-4-8-17(18)20/h3-10,18H,11-15H2,1-2H3/p+2