(2S)-2-[[(E)-2-methylpent-2-enoyl]amino]-2-phenyl-ethanoate

Systemtic Name: (2S)-2-[[(E)-2-methylpent-2-enoyl]amino]-2-phenyl-ethanoate Openeye Name: (2S)-2-[[(E)-2-methylpent-2-enoyl]amino]-2-phenyl-acetate CAS Name: (2S)-2-[[(E)-2-methyl-1-oxopent-2-enyl]amino]-2-phenylacetate IUPAC Name: (2S)-2-[[(E)-2-methylpent-2-enoyl]amino]-2-phenylacetate Traditional Name: (2S)-2-[[(E)-2-methylpent-2-enoyl]amino]-2-phenyl-acetate Formula: C14H16NO3- MolecularWeight: 246.28174

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Descriptors Computed from Structure

Canonical SMILES:

CCC=C(C)C(=O)NC(C1=CC=CC=C1)C(=O)[O-]

Isomeric SMILES

CC/C=C(\C)/C(=O)N[C@@H](C1=CC=CC=C1)C(=O)[O-]

InChI

InChI=1S/C14H17NO3/c1-3-7-10(2)13(16)15-12(14(17)18)11-8-5-4-6-9-11/h4-9,12H,3H2,1-2H3,(H,15,16)(H,17,18)/p-1/b10-7+/t12-/m0/s1