[(E)-3-(2H-chromen-2-ylamino)-1-(3-oxidanylideneprop-2-enoxy)prop-1-en-2-yl] benzoate

Systemtic Name: [(E)-3-(2H-chromen-2-ylamino)-1-(3-oxidanylideneprop-2-enoxy)prop-1-en-2-yl] benzoate Openeye Name: [(E)-1-[(2H-chromen-2-ylamino)methyl]-2-(3-oxoallyloxy)vinyl] benzoate CAS Name: benzoic acid [(E)-3-(2H-1-benzopyran-2-ylamino)-1-(3-oxoprop-2-enoxy)prop-1-en-2-yl] ester IUPAC Name: [(E)-3-(2H-chromen-2-ylamino)-1-(3-oxoprop-2-enoxy)prop-1-en-2-yl] benzoate Traditional Name: benzoic acid [(E)-1-[(2H-chromen-2-ylamino)methyl]-2-(3-ketoallyloxy)vinyl] ester Formula: C22H19NO5 MolecularWeight: 377.38996

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OC(=COCC=C=O)CNC2C=CC3=CC=CC=C3O2

Isomeric SMILES

C1=CC=C(C=C1)C(=O)O/C(=C/OCC=C=O)/CNC2C=CC3=CC=CC=C3O2

InChI

InChI=1S/C22H19NO5/c24-13-6-14-26-16-19(27-22(25)18-8-2-1-3-9-18)15-23-21-12-11-17-7-4-5-10-20(17)28-21/h1-12,16,21,23H,14-15H2/b19-16+