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

Systemtic Name: 3-[(2,2-dimethyl-1,3-dihydrobenzo[f]isoquinolin-4-ylidene)azaniumyl]propanoate Openeye Name: 3-[(2,2-dimethyl-1,3-dihydrobenzo[f]isoquinolin-4-ylidene)ammonio]propanoate CAS Name: 3-[(2,2-dimethyl-1,3-dihydrobenzo[f]isoquinolin-4-ylidene)ammonio]propanoate IUPAC Name: 3-[(2,2-dimethyl-1,3-dihydrobenzo[f]isoquinolin-4-ylidene)azaniumyl]propanoate Traditional Name: 3-[(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:

CC1(CC2=C(C=CC3=CC=CC=C23)C(=[NH+]CCC(=O)[O-])N1)C

Isomeric SMILES

CC1(CC2=C(C=CC3=CC=CC=C23)C(=[NH+]CCC(=O)[O-])N1)C

InChI

InChI=1S/C18H20N2O2/c1-18(2)11-15-13-6-4-3-5-12(13)7-8-14(15)17(20-18)19-10-9-16(21)22/h3-8H,9-11H2,1-2H3,(H,19,20)(H,21,22)