2-morpholin-4-ium-4-ylethyl 11-methyl-5,6-dihydrobenzo[b][1]benzazepine-5-carboxylate chloride

Systemtic Name: 2-morpholin-4-ium-4-ylethyl 11-methyl-5,6-dihydrobenzo[b][1]benzazepine-5-carboxylate chloride Openeye Name: 2-morpholin-4-ium-4-ylethyl 11-methyl-5,6-dihydrobenzo[b][1]benzazepine-5-carboxylate chloride CAS Name: 11-methyl-5,6-dihydrobenzo[b][1]benzazepine-5-carboxylic acid 2-(4-morpholin-4-iumyl)ethyl ester chloride IUPAC Name: 2-morpholin-4-ium-4-ylethyl 11-methyl-5,6-dihydrobenzo[b][1]benzazepine-5-carboxylate chloride Traditional Name: 11-methyl-5,6-dihydrobenzo[b][1]benzazepine-5-carboxylic acid 2-morpholin-4-ium-4-ylethyl ester chloride Formula: C22H27ClN2O3 MolecularWeight: 402.91438

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2CC(C3=CC=CC=C31)C(=O)OCC[NH+]4CCOCC4.[Cl-]

Isomeric SMILES

CN1C2=CC=CC=C2CC(C3=CC=CC=C31)C(=O)OCC[NH+]4CCOCC4.[Cl-]

InChI

InChI=1S/C22H26N2O3.ClH/c1-23-20-8-4-2-6-17(20)16-19(18-7-3-5-9-21(18)23)22(25)27-15-12-24-10-13-26-14-11-24;/h2-9,19H,10-16H2,1H3;1H