[(2S)-1,3-bis(phenylcarbonyloxy)but-3-en-2-yl]-(phenylmethyl)azanium

Systemtic Name: [(2S)-1,3-bis(phenylcarbonyloxy)but-3-en-2-yl]-(phenylmethyl)azanium Openeye Name: [(1S)-2-benzoyloxy-1-(benzoyloxymethyl)allyl]-benzyl-ammonium CAS Name: [(2S)-1,3-dibenzoyloxybut-3-en-2-yl]-(phenylmethyl)ammonium IUPAC Name: benzyl-[(2S)-1,3-dibenzoyloxybut-3-en-2-yl]azanium Traditional Name: [(1S)-2-benzoyloxy-1-(benzoyloxymethyl)allyl]-benzyl-ammonium Formula: C25H24NO4+ MolecularWeight: 402.46236

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C(COC(=O)C1=CC=CC=C1)[NH2+]CC2=CC=CC=C2)OC(=O)C3=CC=CC=C3

Isomeric SMILES

C=C([C@H](COC(=O)C1=CC=CC=C1)[NH2+]CC2=CC=CC=C2)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C25H23NO4/c1-19(30-25(28)22-15-9-4-10-16-22)23(26-17-20-11-5-2-6-12-20)18-29-24(27)21-13-7-3-8-14-21/h2-16,23,26H,1,17-18H2/p+1/t23-/m0/s1