(phenylmethyl) 6-bromanyl-8-nitro-2-oxidanylidene-chromene-3-carboxylate

Systemtic Name: (phenylmethyl) 6-bromanyl-8-nitro-2-oxidanylidene-chromene-3-carboxylate Openeye Name: benzyl 6-bromo-8-nitro-2-oxo-chromene-3-carboxylate CAS Name: 6-bromo-8-nitro-2-oxo-1-benzopyran-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 6-bromo-8-nitro-2-oxochromene-3-carboxylate Traditional Name: 6-bromo-2-keto-8-nitro-chromene-3-carboxylic acid benzyl ester Formula: C17H10BrNO6 MolecularWeight: 404.1684

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C2=CC3=CC(=CC(=C3OC2=O)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C2=CC3=CC(=CC(=C3OC2=O)[N+](=O)[O-])Br

InChI

InChI=1S/C17H10BrNO6/c18-12-6-11-7-13(16(20)24-9-10-4-2-1-3-5-10)17(21)25-15(11)14(8-12)19(22)23/h1-8H,9H2