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

Systemtic Name: butyl 4-[2-[(E)-3-(2-nitrophenyl)prop-2-enoyl]oxyethanoylamino]benzoate Openeye Name: butyl 4-[[2-[(E)-3-(2-nitrophenyl)prop-2-enoyl]oxyacetyl]amino]benzoate CAS Name: 4-[[2-[(E)-3-(2-nitrophenyl)-1-oxoprop-2-enoxy]-1-oxoethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-[(E)-3-(2-nitrophenyl)prop-2-enoyl]oxyacetyl]amino]benzoate Traditional Name: 4-[[2-[(E)-3-(2-nitrophenyl)acryloyl]oxyacetyl]amino]benzoic acid butyl ester Formula: C22H22N2O7 MolecularWeight: 426.41928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22N2O7/c1-2-3-14-30-22(27)17-8-11-18(12-9-17)23-20(25)15-31-21(26)13-10-16-6-4-5-7-19(16)24(28)29/h4-13H,2-3,14-15H2,1H3,(H,23,25)/b13-10+