methyl (2S)-3-phenyl-2-[[4-[(E)-2-phenylethenyl]piperazin-1-yl]carbonylamino]propanoate

Systemtic Name: methyl (2S)-3-phenyl-2-[[4-[(E)-2-phenylethenyl]piperazin-1-yl]carbonylamino]propanoate Openeye Name: methyl (2S)-3-phenyl-2-[[4-[(E)-styryl]piperazine-1-carbonyl]amino]propanoate CAS Name: (2S)-2-[[oxo-[4-[(E)-2-phenylethenyl]-1-piperazinyl]methyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-3-phenyl-2-[[4-[(E)-2-phenylethenyl]piperazine-1-carbonyl]amino]propanoate Traditional Name: (2S)-3-phenyl-2-[[4-[(E)-styryl]piperazine-1-carbonyl]amino]propionic acid methyl ester Formula: C23H27N3O3 MolecularWeight: 393.47878

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)N2CCN(CC2)C=CC3=CC=CC=C3

Isomeric SMILES

COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)N2CCN(CC2)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C23H27N3O3/c1-29-22(27)21(18-20-10-6-3-7-11-20)24-23(28)26-16-14-25(15-17-26)13-12-19-8-4-2-5-9-19/h2-13,21H,14-18H2,1H3,(H,24,28)/b13-12+/t21-/m0/s1