(2R)-2-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)butanoate

Systemtic Name: (2R)-2-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)butanoate Openeye Name: (2R)-2-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)butanoate CAS Name: (2R)-2-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)butanoate IUPAC Name: (2R)-2-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)butanoate Traditional Name: (2R)-2-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)butyrate Formula: C18H18NO2- MolecularWeight: 280.34102

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)[O-])N1C2=CC=CC=C2CCC3=CC=CC=C31

Isomeric SMILES

CC[C@H](C(=O)[O-])N1C2=CC=CC=C2CCC3=CC=CC=C31

InChI

InChI=1S/C18H19NO2/c1-2-15(18(20)21)19-16-9-5-3-7-13(16)11-12-14-8-4-6-10-17(14)19/h3-10,15H,2,11-12H2,1H3,(H,20,21)/p-1/t15-/m1/s1