(2S)-2-[[4-[(E)-2-phenylethenyl]piperazin-4-ium-1-yl]carbonylamino]propanoate

Systemtic Name: (2S)-2-[[4-[(E)-2-phenylethenyl]piperazin-4-ium-1-yl]carbonylamino]propanoate Openeye Name: (2S)-2-[[4-[(E)-styryl]piperazin-4-ium-1-carbonyl]amino]propanoate CAS Name: (2S)-2-[[oxo-[4-[(E)-2-phenylethenyl]-1-piperazin-4-iumyl]methyl]amino]propanoate IUPAC Name: (2S)-2-[[4-[(E)-2-phenylethenyl]piperazin-4-ium-1-carbonyl]amino]propanoate Traditional Name: (2S)-2-[[4-[(E)-styryl]piperazin-4-ium-1-carbonyl]amino]propionate Formula: C16H21N3O3 MolecularWeight: 303.35624

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])NC(=O)N1CC[NH+](CC1)C=CC2=CC=CC=C2

Isomeric SMILES

C[C@@H](C(=O)[O-])NC(=O)N1CC[NH+](CC1)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C16H21N3O3/c1-13(15(20)21)17-16(22)19-11-9-18(10-12-19)8-7-14-5-3-2-4-6-14/h2-8,13H,9-12H2,1H3,(H,17,22)(H,20,21)/b8-7+/t13-/m0/s1