ethyl (3S)-1-[2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxyethanoyl]piperidine-3-carboxylate

Systemtic Name: ethyl (3S)-1-[2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxyethanoyl]piperidine-3-carboxylate Openeye Name: ethyl (3S)-1-[2-(4-methyl-2-oxo-chromen-7-yl)oxyacetyl]piperidine-3-carboxylate CAS Name: (3S)-1-[2-[(4-methyl-2-oxo-1-benzopyran-7-yl)oxy]-1-oxoethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-[2-(4-methyl-2-oxochromen-7-yl)oxyacetyl]piperidine-3-carboxylate Traditional Name: (3S)-1-[2-(2-keto-4-methyl-chromen-7-yl)oxyacetyl]nipecotic acid ethyl ester Formula: C20H23NO6 MolecularWeight: 373.39972

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)COC2=CC3=C(C=C2)C(=CC(=O)O3)C

Isomeric SMILES

CCOC(=O)[C@H]1CCCN(C1)C(=O)COC2=CC3=C(C=C2)C(=CC(=O)O3)C

InChI

InChI=1S/C20H23NO6/c1-3-25-20(24)14-5-4-8-21(11-14)18(22)12-26-15-6-7-16-13(2)9-19(23)27-17(16)10-15/h6-7,9-10,14H,3-5,8,11-12H2,1-2H3/t14-/m0/s1