N-(3-bromanyl-4-methyl-phenyl)-2-(4-phenylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(3-bromanyl-4-methyl-phenyl)-2-(4-phenylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(3-bromo-4-methyl-phenyl)-2-(4-phenylpiperazin-1-ium-1-yl)acetamide CAS Name: N-(3-bromo-4-methylphenyl)-2-(4-phenyl-1-piperazin-1-iumyl)acetamide IUPAC Name: N-(3-bromo-4-methylphenyl)-2-(4-phenylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-(3-bromo-4-methyl-phenyl)-2-(4-phenylpiperazin-1-ium-1-yl)acetamide Formula: C19H23BrN3O+ MolecularWeight: 389.30942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C[NH+]2CCN(CC2)C3=CC=CC=C3)Br

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C[NH+]2CCN(CC2)C3=CC=CC=C3)Br

InChI

InChI=1S/C19H22BrN3O/c1-15-7-8-16(13-18(15)20)21-19(24)14-22-9-11-23(12-10-22)17-5-3-2-4-6-17/h2-8,13H,9-12,14H2,1H3,(H,21,24)/p+1