[2-(1-adamantyl)-2-oxidanylidene-ethyl] 2-[[(E)-3-phenylprop-2-enoyl]amino]ethanoate

Systemtic Name: [2-(1-adamantyl)-2-oxidanylidene-ethyl] 2-[[(E)-3-phenylprop-2-enoyl]amino]ethanoate Openeye Name: [2-(1-adamantyl)-2-oxo-ethyl] 2-[[(E)-3-phenylprop-2-enoyl]amino]acetate CAS Name: 2-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]acetic acid [2-(1-adamantyl)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantyl)-2-oxoethyl] 2-[[(E)-3-phenylprop-2-enoyl]amino]acetate Traditional Name: 2-[[(E)-3-phenylacryloyl]amino]acetic acid [2-(1-adamantyl)-2-keto-ethyl] ester Formula: C23H27NO4 MolecularWeight: 381.46478

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)COC(=O)CNC(=O)C=CC4=CC=CC=C4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)COC(=O)CNC(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C23H27NO4/c25-20(23-11-17-8-18(12-23)10-19(9-17)13-23)15-28-22(27)14-24-21(26)7-6-16-4-2-1-3-5-16/h1-7,17-19H,8-15H2,(H,24,26)/b7-6+