(2R)-2-[(2,2-dimethyl-1,3-dihydrobenzo[f]isoquinolin-4-ylidene)azaniumyl]propanoate

Systemtic Name: (2R)-2-[(2,2-dimethyl-1,3-dihydrobenzo[f]isoquinolin-4-ylidene)azaniumyl]propanoate Openeye Name: (2R)-2-[(2,2-dimethyl-1,3-dihydrobenzo[f]isoquinolin-4-ylidene)ammonio]propanoate CAS Name: (2R)-2-[(2,2-dimethyl-1,3-dihydrobenzo[f]isoquinolin-4-ylidene)ammonio]propanoate IUPAC Name: (2R)-2-[(2,2-dimethyl-1,3-dihydrobenzo[f]isoquinolin-4-ylidene)azaniumyl]propanoate Traditional Name: (2R)-2-[(2,2-dimethyl-1,3-dihydrobenz[f]isoquinolin-4-ylidene)ammonio]propionate Formula: C18H20N2O2 MolecularWeight: 296.3636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])[NH+]=C1C2=C(CC(N1)(C)C)C3=CC=CC=C3C=C2

Isomeric SMILES

C[C@H](C(=O)[O-])[NH+]=C1C2=C(CC(N1)(C)C)C3=CC=CC=C3C=C2

InChI

InChI=1S/C18H20N2O2/c1-11(17(21)22)19-16-14-9-8-12-6-4-5-7-13(12)15(14)10-18(2,3)20-16/h4-9,11H,10H2,1-3H3,(H,19,20)(H,21,22)/t11-/m1/s1