(3-oxidanylidenebenzo[f]chromen-1-yl)methyl 2-[(3-chloranyl-5-nitro-phenyl)carbonylamino]ethanoate

Systemtic Name: (3-oxidanylidenebenzo[f]chromen-1-yl)methyl 2-[(3-chloranyl-5-nitro-phenyl)carbonylamino]ethanoate Openeye Name: (3-oxobenzo[f]chromen-1-yl)methyl 2-[(3-chloro-5-nitro-benzoyl)amino]acetate CAS Name: 2-[[(3-chloro-5-nitrophenyl)-oxomethyl]amino]acetic acid (3-oxo-1-benzo[f][1]benzopyranyl)methyl ester IUPAC Name: (3-oxobenzo[f]chromen-1-yl)methyl 2-[(3-chloro-5-nitrobenzoyl)amino]acetate Traditional Name: 2-[(3-chloro-5-nitro-benzoyl)amino]acetic acid (3-ketobenzo[f]chromen-1-yl)methyl ester Formula: C23H15ClN2O7 MolecularWeight: 466.8274

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C2C(=CC(=O)O3)COC(=O)CNC(=O)C4=CC(=CC(=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C2C(=CC(=O)O3)COC(=O)CNC(=O)C4=CC(=CC(=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C23H15ClN2O7/c24-16-7-14(8-17(10-16)26(30)31)23(29)25-11-21(28)32-12-15-9-20(27)33-19-6-5-13-3-1-2-4-18(13)22(15)19/h1-10H,11-12H2,(H,25,29)