(2R)-2-(1,3,4,5-tetrahydro-1-benzazepin-2-ylideneazaniumyl)propanoate

Systemtic Name: (2R)-2-(1,3,4,5-tetrahydro-1-benzazepin-2-ylideneazaniumyl)propanoate Openeye Name: (2R)-2-(1,3,4,5-tetrahydro-1-benzazepin-2-ylideneammonio)propanoate CAS Name: (2R)-2-(1,3,4,5-tetrahydro-1-benzazepin-2-ylideneammonio)propanoate IUPAC Name: (2R)-2-(1,3,4,5-tetrahydro-1-benzazepin-2-ylideneazaniumyl)propanoate Traditional Name: (2R)-2-(1,3,4,5-tetrahydro-1-benzazepin-2-ylideneammonio)propionate Formula: C13H16N2O2 MolecularWeight: 232.27834

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])[NH+]=C1CCCC2=CC=CC=C2N1

Isomeric SMILES

C[C@H](C(=O)[O-])[NH+]=C1CCCC2=CC=CC=C2N1

InChI

InChI=1S/C13H16N2O2/c1-9(13(16)17)14-12-8-4-6-10-5-2-3-7-11(10)15-12/h2-3,5,7,9H,4,6,8H2,1H3,(H,14,15)(H,16,17)/t9-/m1/s1