(2S)-2-(4-cyclopropylcarbonylpiperazin-1-ium-1-yl)-N-(2,5-dimethylphenyl)-2-phenyl-ethanamide

Systemtic Name: (2S)-2-(4-cyclopropylcarbonylpiperazin-1-ium-1-yl)-N-(2,5-dimethylphenyl)-2-phenyl-ethanamide Openeye Name: (2S)-2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]-N-(2,5-dimethylphenyl)-2-phenyl-acetamide CAS Name: (2S)-2-[4-[cyclopropyl(oxo)methyl]-1-piperazin-1-iumyl]-N-(2,5-dimethylphenyl)-2-phenylacetamide IUPAC Name: (2S)-2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]-N-(2,5-dimethylphenyl)-2-phenylacetamide Traditional Name: (2S)-2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]-N-(2,5-dimethylphenyl)-2-phenyl-acetamide Formula: C24H30N3O2+ MolecularWeight: 392.5139

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C(C2=CC=CC=C2)[NH+]3CCN(CC3)C(=O)C4CC4

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)[C@H](C2=CC=CC=C2)[NH+]3CCN(CC3)C(=O)C4CC4

InChI

InChI=1S/C24H29N3O2/c1-17-8-9-18(2)21(16-17)25-23(28)22(19-6-4-3-5-7-19)26-12-14-27(15-13-26)24(29)20-10-11-20/h3-9,16,20,22H,10-15H2,1-2H3,(H,25,28)/p+1/t22-/m0/s1