7-[3-[4-[oxidanyl(diphenyl)methyl]piperidin-1-yl]propoxy]-4-oxidanylidene-chromene-2-carboxylic acid

Systemtic Name: 7-[3-[4-[oxidanyl(diphenyl)methyl]piperidin-1-yl]propoxy]-4-oxidanylidene-chromene-2-carboxylic acid Openeye Name: 7-[3-[4-[hydroxy(diphenyl)methyl]-1-piperidyl]propoxy]-4-oxo-chromene-2-carboxylic acid CAS Name: 7-[3-[4-[hydroxy(diphenyl)methyl]-1-piperidinyl]propoxy]-4-oxo-1-benzopyran-2-carboxylic acid IUPAC Name: 7-[3-[4-[hydroxy(diphenyl)methyl]piperidin-1-yl]propoxy]-4-oxochromene-2-carboxylic acid Traditional Name: 7-[3-[4-[hydroxy(diphenyl)methyl]piperidino]propoxy]-4-keto-chromene-2-carboxylic acid Formula: C31H31NO6 MolecularWeight: 513.58094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(C2=CC=CC=C2)(C3=CC=CC=C3)O)CCCOC4=CC5=C(C=C4)C(=O)C=C(O5)C(=O)O

Isomeric SMILES

C1CN(CCC1C(C2=CC=CC=C2)(C3=CC=CC=C3)O)CCCOC4=CC5=C(C=C4)C(=O)C=C(O5)C(=O)O

InChI

InChI=1S/C31H31NO6/c33-27-21-29(30(34)35)38-28-20-25(12-13-26(27)28)37-19-7-16-32-17-14-24(15-18-32)31(36,22-8-3-1-4-9-22)23-10-5-2-6-11-23/h1-6,8-13,20-21,24,36H,7,14-19H2,(H,34,35)