2-[(4-methoxy-2-nitro-3-pentoxy-phenyl)carbonyl-[2-(4-nitrophenyl)ethyl]amino]ethanoate

Systemtic Name: 2-[(4-methoxy-2-nitro-3-pentoxy-phenyl)carbonyl-[2-(4-nitrophenyl)ethyl]amino]ethanoate Openeye Name: 2-[(4-methoxy-2-nitro-3-pentoxy-benzoyl)-[2-(4-nitrophenyl)ethyl]amino]acetate CAS Name: 2-[[(4-methoxy-2-nitro-3-pentoxyphenyl)-oxomethyl]-[2-(4-nitrophenyl)ethyl]amino]acetate IUPAC Name: 2-[(4-methoxy-2-nitro-3-pentoxybenzoyl)-[2-(4-nitrophenyl)ethyl]amino]acetate Traditional Name: 2-[(3-amoxy-4-methoxy-2-nitro-benzoyl)-[2-(4-nitrophenyl)ethyl]amino]acetate Formula: C23H26N3O9- MolecularWeight: 488.46724

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=CC(=C1[N+](=O)[O-])C(=O)N(CCC2=CC=C(C=C2)[N+](=O)[O-])CC(=O)[O-])OC

Isomeric SMILES

CCCCCOC1=C(C=CC(=C1[N+](=O)[O-])C(=O)N(CCC2=CC=C(C=C2)[N+](=O)[O-])CC(=O)[O-])OC

InChI

InChI=1S/C23H27N3O9/c1-3-4-5-14-35-22-19(34-2)11-10-18(21(22)26(32)33)23(29)24(15-20(27)28)13-12-16-6-8-17(9-7-16)25(30)31/h6-11H,3-5,12-15H2,1-2H3,(H,27,28)/p-1