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propyl 4-[2-[5-[(3-nitrophenyl)amino]-5-oxidanylidene-pentanoyl]oxyethanoylamino]benzoate

propyl 4-[2-[5-[(3-nitrophenyl)amino]-5-oxidanylidene-pentanoyl]oxyethanoylamino]benzoate

Systemtic Name:propyl 4-[2-[5-[(3-nitrophenyl)amino]-5-oxidanylidene-pentanoyl]oxyethanoylamino]benzoate
Openeye Name:propyl 4-[[2-[5-(3-nitroanilino)-5-oxo-pentanoyl]oxyacetyl]amino]benzoate
CAS Name:4-[[2-[5-(3-nitroanilino)-1,5-dioxopentoxy]-1-oxoethyl]amino]benzoic acid propyl ester
IUPAC Name:propyl 4-[[2-[5-(3-nitroanilino)-5-oxopentanoyl]oxyacetyl]amino]benzoate
Traditional Name:4-[[2-[5-keto-5-(3-nitroanilino)pentanoyl]oxyacetyl]amino]benzoic acid propyl ester
Formula: C23H25N3O8
MolecularWeight: 471.4599
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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)CCCC(=O)NC2=CC(=CC=C2)[N+](=O)[O-]


Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)CCCC(=O)NC2=CC(=CC=C2)[N+](=O)[O-]


InChI

InChI=1S/C23H25N3O8/c1-2-13-33-23(30)16-9-11-17(12-10-16)24-21(28)15-34-22(29)8-4-7-20(27)25-18-5-3-6-19(14-18)26(31)32/h3,5-6,9-12,14H,2,4,7-8,13,15H2,1H3,(H,24,28)(H,25,27)


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