(7-bromanyl-2-oxidanylidene-chromen-4-yl)methyl 2-[(3-nitrophenyl)carbonylamino]ethanoate

Systemtic Name: (7-bromanyl-2-oxidanylidene-chromen-4-yl)methyl 2-[(3-nitrophenyl)carbonylamino]ethanoate Openeye Name: (7-bromo-2-oxo-chromen-4-yl)methyl 2-[(3-nitrobenzoyl)amino]acetate CAS Name: 2-[[(3-nitrophenyl)-oxomethyl]amino]acetic acid (7-bromo-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-bromo-2-oxochromen-4-yl)methyl 2-[(3-nitrobenzoyl)amino]acetate Traditional Name: 2-[(3-nitrobenzoyl)amino]acetic acid (7-bromo-2-keto-chromen-4-yl)methyl ester Formula: C19H13BrN2O7 MolecularWeight: 461.21972

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NCC(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)Br

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NCC(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)Br

InChI

InChI=1S/C19H13BrN2O7/c20-13-4-5-15-12(7-17(23)29-16(15)8-13)10-28-18(24)9-21-19(25)11-2-1-3-14(6-11)22(26)27/h1-8H,9-10H2,(H,21,25)