(2R)-N-aminocarbonyl-2-[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]-2-phenyl-ethanamide

Systemtic Name: (2R)-N-aminocarbonyl-2-[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]-2-phenyl-ethanamide Openeye Name: (2R)-N-carbamoyl-2-[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]-2-phenyl-acetamide CAS Name: (2R)-N-carbamoyl-2-[4-(2,3-dimethylphenyl)-1-piperazin-1-iumyl]-2-phenylacetamide IUPAC Name: (2R)-N-carbamoyl-2-[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]-2-phenylacetamide Traditional Name: (2R)-N-carbamoyl-2-[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]-2-phenyl-acetamide Formula: C21H27N4O2+ MolecularWeight: 367.46468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CC[NH+](CC2)C(C3=CC=CC=C3)C(=O)NC(=O)N)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CC[NH+](CC2)[C@H](C3=CC=CC=C3)C(=O)NC(=O)N)C

InChI

InChI=1S/C21H26N4O2/c1-15-7-6-10-18(16(15)2)24-11-13-25(14-12-24)19(20(26)23-21(22)27)17-8-4-3-5-9-17/h3-10,19H,11-14H2,1-2H3,(H3,22,23,26,27)/p+1/t19-/m1/s1