1-[2-(6-oxidanylidenebenzo[c]chromen-3-yl)oxyethanoyl]-4-phenyl-piperidine-4-carboxylic acid

Systemtic Name: 1-[2-(6-oxidanylidenebenzo[c]chromen-3-yl)oxyethanoyl]-4-phenyl-piperidine-4-carboxylic acid Openeye Name: 1-[2-(6-oxobenzo[c]chromen-3-yl)oxyacetyl]-4-phenyl-piperidine-4-carboxylic acid CAS Name: 1-[1-oxo-2-[(6-oxo-3-benzo[c][1]benzopyranyl)oxy]ethyl]-4-phenyl-4-piperidinecarboxylic acid IUPAC Name: 1-[2-(6-oxobenzo[c]chromen-3-yl)oxyacetyl]-4-phenylpiperidine-4-carboxylic acid Traditional Name: 1-[2-(6-ketobenzo[c]chromen-3-yl)oxyacetyl]-4-phenyl-isonipecotic acid Formula: C27H23NO6 MolecularWeight: 457.47462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC=CC=C2)C(=O)O)C(=O)COC3=CC4=C(C=C3)C5=CC=CC=C5C(=O)O4

Isomeric SMILES

C1CN(CCC1(C2=CC=CC=C2)C(=O)O)C(=O)COC3=CC4=C(C=C3)C5=CC=CC=C5C(=O)O4

InChI

InChI=1S/C27H23NO6/c29-24(28-14-12-27(13-15-28,26(31)32)18-6-2-1-3-7-18)17-33-19-10-11-21-20-8-4-5-9-22(20)25(30)34-23(21)16-19/h1-11,16H,12-15,17H2,(H,31,32)