ethyl (3S)-1-[6,8-bis(bromanyl)-2-oxidanylidene-chromen-3-yl]carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl (3S)-1-[6,8-bis(bromanyl)-2-oxidanylidene-chromen-3-yl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl (3S)-1-(6,8-dibromo-2-oxo-chromene-3-carbonyl)piperidine-3-carboxylate CAS Name: (3S)-1-[(6,8-dibromo-2-oxo-1-benzopyran-3-yl)-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-(6,8-dibromo-2-oxochromene-3-carbonyl)piperidine-3-carboxylate Traditional Name: (3S)-1-(6,8-dibromo-2-keto-chromene-3-carbonyl)nipecotic acid ethyl ester Formula: C18H17Br2NO5 MolecularWeight: 487.13928

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=CC3=CC(=CC(=C3OC2=O)Br)Br

Isomeric SMILES

CCOC(=O)[C@H]1CCCN(C1)C(=O)C2=CC3=CC(=CC(=C3OC2=O)Br)Br

InChI

InChI=1S/C18H17Br2NO5/c1-2-25-17(23)10-4-3-5-21(9-10)16(22)13-7-11-6-12(19)8-14(20)15(11)26-18(13)24/h6-8,10H,2-5,9H2,1H3/t10-/m0/s1