2,2-dimethyl-4-(2-pyrrolidin-1-ium-1-ylethyl)-1H-benzo[f]isoquinoline

Systemtic Name: 2,2-dimethyl-4-(2-pyrrolidin-1-ium-1-ylethyl)-1H-benzo[f]isoquinoline Openeye Name: 2,2-dimethyl-4-(2-pyrrolidin-1-ium-1-ylethyl)-1H-benzo[f]isoquinoline CAS Name: 2,2-dimethyl-4-[2-(1-pyrrolidin-1-iumyl)ethyl]-1H-benzo[f]isoquinoline IUPAC Name: 2,2-dimethyl-4-(2-pyrrolidin-1-ium-1-ylethyl)-1H-benzo[f]isoquinoline Traditional Name: 2,2-dimethyl-4-(2-pyrrolidin-1-ium-1-ylethyl)-1H-benz[f]isoquinoline Formula: C21H27N2+ MolecularWeight: 307.45248

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C=CC3=CC=CC=C23)C(=N1)CC[NH+]4CCCC4)C

Isomeric SMILES

CC1(CC2=C(C=CC3=CC=CC=C23)C(=N1)CC[NH+]4CCCC4)C

InChI

InChI=1S/C21H26N2/c1-21(2)15-19-17-8-4-3-7-16(17)9-10-18(19)20(22-21)11-14-23-12-5-6-13-23/h3-4,7-10H,5-6,11-15H2,1-2H3/p+1