[(2S)-3-(phenylcarbonyloxy)-2-[(phenylmethyl)amino]but-3-enyl] benzoate

Systemtic Name: [(2S)-3-(phenylcarbonyloxy)-2-[(phenylmethyl)amino]but-3-enyl] benzoate Openeye Name: [(2S)-3-benzoyloxy-2-(benzylamino)but-3-enyl] benzoate CAS Name: benzoic acid [(2S)-3-benzoyloxy-2-[(phenylmethyl)amino]but-3-enyl] ester IUPAC Name: [(2S)-3-benzoyloxy-2-(benzylamino)but-3-enyl] benzoate Traditional Name: benzoic acid [(2S)-3-benzoyloxy-2-(benzylamino)but-3-enyl] ester Formula: C25H23NO4 MolecularWeight: 401.45442

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C(COC(=O)C1=CC=CC=C1)NCC2=CC=CC=C2)OC(=O)C3=CC=CC=C3

Isomeric SMILES

C=C([C@H](COC(=O)C1=CC=CC=C1)NCC2=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/t23-/m0/s1