propyl 4-[2-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]oxyethanoylamino]benzoate

Systemtic Name: propyl 4-[2-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]oxyethanoylamino]benzoate Openeye Name: propyl 4-[[2-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]oxyacetyl]amino]benzoate CAS Name: 4-[[2-[(E)-3-(1,3-benzodioxol-5-yl)-1-oxoprop-2-enoxy]-1-oxoethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[[2-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]oxyacetyl]amino]benzoate Traditional Name: 4-[[2-[(E)-3-(1,3-benzodioxol-5-yl)acryloyl]oxyacetyl]amino]benzoic acid propyl ester Formula: C22H21NO7 MolecularWeight: 411.40464

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)C=CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)/C=C/C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C22H21NO7/c1-2-11-27-22(26)16-5-7-17(8-6-16)23-20(24)13-28-21(25)10-4-15-3-9-18-19(12-15)30-14-29-18/h3-10,12H,2,11,13-14H2,1H3,(H,23,24)/b10-4+