2-[[(5S)-5-ethoxy-5,6-dihydrobenzo[b][1]benzazepin-11-yl]carbonylamino]ethyl-diethyl-azanium

Systemtic Name: 2-[[(5S)-5-ethoxy-5,6-dihydrobenzo[b][1]benzazepin-11-yl]carbonylamino]ethyl-diethyl-azanium Openeye Name: 2-[[(5S)-5-ethoxy-5,6-dihydrobenzo[b][1]benzazepine-11-carbonyl]amino]ethyl-diethyl-ammonium CAS Name: 2-[[[(5S)-5-ethoxy-5,6-dihydrobenzo[b][1]benzazepin-11-yl]-oxomethyl]amino]ethyl-diethylammonium IUPAC Name: 2-[[(5S)-5-ethoxy-5,6-dihydrobenzo[b][1]benzazepine-11-carbonyl]amino]ethyl-diethylazanium Traditional Name: 2-[[(5S)-5-ethoxy-5,6-dihydrobenzo[b][1]benzazepine-11-carbonyl]amino]ethyl-diethyl-ammonium Formula: C23H32N3O2+ MolecularWeight: 382.51908

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC(=O)N1C2=CC=CC=C2CC(C3=CC=CC=C31)OCC

Isomeric SMILES

CC[NH+](CC)CCNC(=O)N1C2=CC=CC=C2C[C@@H](C3=CC=CC=C31)OCC

InChI

InChI=1S/C23H31N3O2/c1-4-25(5-2)16-15-24-23(27)26-20-13-9-7-11-18(20)17-22(28-6-3)19-12-8-10-14-21(19)26/h7-14,22H,4-6,15-17H2,1-3H3,(H,24,27)/p+1/t22-/m0/s1