2-phenanthridin-5-ium-5-yl-N,N-di(propan-2-yl)ethanamide bromide

Systemtic Name: 2-phenanthridin-5-ium-5-yl-N,N-di(propan-2-yl)ethanamide bromide Openeye Name: N,N-diisopropyl-2-phenanthridin-5-ium-5-yl-acetamide bromide CAS Name: 2-(5-phenanthridin-5-iumyl)-N,N-di(propan-2-yl)acetamide bromide IUPAC Name: 2-phenanthridin-5-ium-5-yl-N,N-di(propan-2-yl)acetamide bromide Traditional Name: N,N-diisopropyl-2-phenanthridin-5-ium-5-yl-acetamide bromide Formula: C21H25BrN2O MolecularWeight: 401.34

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C(C)C)C(=O)C[N+]1=CC2=CC=CC=C2C3=CC=CC=C31.[Br-]

Isomeric SMILES

CC(C)N(C(C)C)C(=O)C[N+]1=CC2=CC=CC=C2C3=CC=CC=C31.[Br-]

InChI

InChI=1S/C21H25N2O.BrH/c1-15(2)23(16(3)4)21(24)14-22-13-17-9-5-6-10-18(17)19-11-7-8-12-20(19)22;/h5-13,15-16H,14H2,1-4H3;1H/q+1;/p-1