(2R)-N-methyl-N-phenyl-2-[[4-[4-(phenylmethyl)piperazin-4-ium-1-yl]phenyl]amino]propanamide

Systemtic Name: (2R)-N-methyl-N-phenyl-2-[[4-[4-(phenylmethyl)piperazin-4-ium-1-yl]phenyl]amino]propanamide Openeye Name: (2R)-2-[4-(4-benzylpiperazin-4-ium-1-yl)anilino]-N-methyl-N-phenyl-propanamide CAS Name: (2R)-N-methyl-N-phenyl-2-[4-[4-(phenylmethyl)-1-piperazin-4-iumyl]anilino]propanamide IUPAC Name: (2R)-2-[4-(4-benzylpiperazin-4-ium-1-yl)anilino]-N-methyl-N-phenylpropanamide Traditional Name: (2R)-2-[4-(4-benzylpiperazin-4-ium-1-yl)anilino]-N-methyl-N-phenyl-propionamide Formula: C27H33N4O+ MolecularWeight: 429.57712

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)C1=CC=CC=C1)NC2=CC=C(C=C2)N3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

C[C@H](C(=O)N(C)C1=CC=CC=C1)NC2=CC=C(C=C2)N3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C27H32N4O/c1-22(27(32)29(2)25-11-7-4-8-12-25)28-24-13-15-26(16-14-24)31-19-17-30(18-20-31)21-23-9-5-3-6-10-23/h3-16,22,28H,17-21H2,1-2H3/p+1/t22-/m1/s1