methyl 1-[2-(3-methoxy-6-oxidanylidene-xanthen-9-yl)phenyl]carbonylpiperidine-4-carboxylate

Systemtic Name: methyl 1-[2-(3-methoxy-6-oxidanylidene-xanthen-9-yl)phenyl]carbonylpiperidine-4-carboxylate Openeye Name: methyl 1-[2-(3-methoxy-6-oxo-xanthen-9-yl)benzoyl]piperidine-4-carboxylate CAS Name: 1-[[2-(3-methoxy-6-oxo-9-xanthenyl)phenyl]-oxomethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(3-methoxy-6-oxoxanthen-9-yl)benzoyl]piperidine-4-carboxylate Traditional Name: 1-[2-(3-keto-6-methoxy-xanthen-9-yl)benzoyl]isonipecotic acid methyl ester Formula: C28H25NO6 MolecularWeight: 471.5012

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=C3C=CC(=O)C=C3O2)C4=CC=CC=C4C(=O)N5CCC(CC5)C(=O)OC

Isomeric SMILES

COC1=CC2=C(C=C1)C(=C3C=CC(=O)C=C3O2)C4=CC=CC=C4C(=O)N5CCC(CC5)C(=O)OC

InChI

InChI=1S/C28H25NO6/c1-33-19-8-10-23-25(16-19)35-24-15-18(30)7-9-22(24)26(23)20-5-3-4-6-21(20)27(31)29-13-11-17(12-14-29)28(32)34-2/h3-10,15-17H,11-14H2,1-2H3