5-(2-bromoethyl)-N-[(1R)-1-(4-methoxyphenyl)ethyl]phenanthridin-5-ium-6-amine bromide

Systemtic Name: 5-(2-bromoethyl)-N-[(1R)-1-(4-methoxyphenyl)ethyl]phenanthridin-5-ium-6-amine bromide Openeye Name: 5-(2-bromoethyl)-N-[(1R)-1-(4-methoxyphenyl)ethyl]phenanthridin-5-ium-6-amine bromide CAS Name: 5-(2-bromoethyl)-N-[(1R)-1-(4-methoxyphenyl)ethyl]-6-phenanthridin-5-iumamine bromide IUPAC Name: 5-(2-bromoethyl)-N-[(1R)-1-(4-methoxyphenyl)ethyl]phenanthridin-5-ium-6-amine bromide Traditional Name: [5-(2-bromoethyl)phenanthridin-5-ium-6-yl]-[(1R)-1-(4-methoxyphenyl)ethyl]amine bromide Formula: C24H24Br2N2O MolecularWeight: 516.26816

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)OC)NC2=[N+](C3=CC=CC=C3C4=CC=CC=C42)CCBr.[Br-]

Isomeric SMILES

C[C@H](C1=CC=C(C=C1)OC)NC2=[N+](C3=CC=CC=C3C4=CC=CC=C42)CCBr.[Br-]

InChI

InChI=1S/C24H23BrN2O.BrH/c1-17(18-11-13-19(28-2)14-12-18)26-24-22-9-4-3-7-20(22)21-8-5-6-10-23(21)27(24)16-15-25;/h3-14,17H,15-16H2,1-2H3;1H/t17-;/m1./s1