propyl 4-[2-[(E)-3-(4-nitrophenyl)prop-2-enoyl]oxyethanoylamino]benzoate

Systemtic Name: propyl 4-[2-[(E)-3-(4-nitrophenyl)prop-2-enoyl]oxyethanoylamino]benzoate Openeye Name: propyl 4-[[2-[(E)-3-(4-nitrophenyl)prop-2-enoyl]oxyacetyl]amino]benzoate CAS Name: 4-[[2-[(E)-3-(4-nitrophenyl)-1-oxoprop-2-enoxy]-1-oxoethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[[2-[(E)-3-(4-nitrophenyl)prop-2-enoyl]oxyacetyl]amino]benzoate Traditional Name: 4-[[2-[(E)-3-(4-nitrophenyl)acryloyl]oxyacetyl]amino]benzoic acid propyl ester Formula: C21H20N2O7 MolecularWeight: 412.3927

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)C=CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)/C=C/C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C21H20N2O7/c1-2-13-29-21(26)16-6-8-17(9-7-16)22-19(24)14-30-20(25)12-5-15-3-10-18(11-4-15)23(27)28/h3-12H,2,13-14H2,1H3,(H,22,24)/b12-5+