[(Z,2S,3R)-2-azanyl-6-ethoxy-1-oxidanyl-6-oxidanylidene-hex-4-en-3-yl] benzoate

Systemtic Name: [(Z,2S,3R)-2-azanyl-6-ethoxy-1-oxidanyl-6-oxidanylidene-hex-4-en-3-yl] benzoate Openeye Name: [(Z,1R)-1-[(1S)-1-amino-2-hydroxy-ethyl]-4-ethoxy-4-oxo-but-2-enyl] benzoate CAS Name: benzoic acid [(Z,2S,3R)-2-amino-6-ethoxy-1-hydroxy-6-oxohex-4-en-3-yl] ester IUPAC Name: [(Z,2S,3R)-2-amino-6-ethoxy-1-hydroxy-6-oxohex-4-en-3-yl] benzoate Traditional Name: benzoic acid [(Z,1R)-1-[(1S)-1-amino-2-hydroxy-ethyl]-4-ethoxy-4-keto-but-2-enyl] ester Formula: C15H19NO5 MolecularWeight: 293.31506

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(C(CO)N)OC(=O)C1=CC=CC=C1

Isomeric SMILES

CCOC(=O)/C=C\[C@H]([C@H](CO)N)OC(=O)C1=CC=CC=C1

InChI

InChI=1S/C15H19NO5/c1-2-20-14(18)9-8-13(12(16)10-17)21-15(19)11-6-4-3-5-7-11/h3-9,12-13,17H,2,10,16H2,1H3/b9-8-/t12-,13+/m0/s1