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

Systemtic Name: (2R)-N-aminocarbonyl-2-[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]propanamide Openeye Name: (2R)-N-carbamoyl-2-[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]propanamide CAS Name: (2R)-N-carbamoyl-2-[4-(2,3-dimethylphenyl)-1-piperazin-1-iumyl]propanamide IUPAC Name: (2R)-N-carbamoyl-2-[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]propanamide Traditional Name: (2R)-N-carbamoyl-2-[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]propionamide Formula: C16H25N4O2+ MolecularWeight: 305.3953

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24N4O2/c1-11-5-4-6-14(12(11)2)20-9-7-19(8-10-20)13(3)15(21)18-16(17)22/h4-6,13H,7-10H2,1-3H3,(H3,17,18,21,22)/p+1/t13-/m1/s1