3-[[(5S)-5-ethoxy-5,6-dihydrobenzo[b][1]benzazepin-11-yl]carbonylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[[(5S)-5-ethoxy-5,6-dihydrobenzo[b][1]benzazepin-11-yl]carbonylamino]propyl-dimethyl-azanium Openeye Name: 3-[[(5S)-5-ethoxy-5,6-dihydrobenzo[b][1]benzazepine-11-carbonyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[[(5S)-5-ethoxy-5,6-dihydrobenzo[b][1]benzazepin-11-yl]-oxomethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[(5S)-5-ethoxy-5,6-dihydrobenzo[b][1]benzazepine-11-carbonyl]amino]propyl-dimethylazanium Traditional Name: 3-[[(5S)-5-ethoxy-5,6-dihydrobenzo[b][1]benzazepine-11-carbonyl]amino]propyl-dimethyl-ammonium Formula: C22H30N3O2+ MolecularWeight: 368.4925

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1CC2=CC=CC=C2N(C3=CC=CC=C13)C(=O)NCCC[NH+](C)C

Isomeric SMILES

CCO[C@H]1CC2=CC=CC=C2N(C3=CC=CC=C13)C(=O)NCCC[NH+](C)C

InChI

InChI=1S/C22H29N3O2/c1-4-27-21-16-17-10-5-7-12-19(17)25(20-13-8-6-11-18(20)21)22(26)23-14-9-15-24(2)3/h5-8,10-13,21H,4,9,14-16H2,1-3H3,(H,23,26)/p+1/t21-/m0/s1