ethyl (6S,7S)-5-bromanyl-7-(3-nitrophenyl)-11-oxidanyl-10-oxaspiro[5.5]undeca-4,8-diene-9-carboxylate

Systemtic Name: ethyl (6S,7S)-5-bromanyl-7-(3-nitrophenyl)-11-oxidanyl-10-oxaspiro[5.5]undeca-4,8-diene-9-carboxylate Openeye Name: ethyl (6S,7S)-5-bromo-11-hydroxy-7-(3-nitrophenyl)-10-oxaspiro[5.5]undeca-4,8-diene-9-carboxylate CAS Name: (6S,7S)-5-bromo-11-hydroxy-7-(3-nitrophenyl)-10-oxaspiro[5.5]undeca-4,8-diene-9-carboxylic acid ethyl ester IUPAC Name: ethyl (6S,7S)-5-bromo-11-hydroxy-7-(3-nitrophenyl)-10-oxaspiro[5.5]undeca-4,8-diene-9-carboxylate Traditional Name: (6S,7S)-5-bromo-11-hydroxy-7-(3-nitrophenyl)-10-oxaspiro[5.5]undeca-4,8-diene-9-carboxylic acid ethyl ester Formula: C19H20BrNO6 MolecularWeight: 438.2692

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(C2(CCCC=C2Br)C(O1)O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C[C@H]([C@@]2(CCCC=C2Br)C(O1)O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H20BrNO6/c1-2-26-17(22)15-11-14(12-6-5-7-13(10-12)21(24)25)19(18(23)27-15)9-4-3-8-16(19)20/h5-8,10-11,14,18,23H,2-4,9H2,1H3/t14-,18?,19+/m0/s1