3-[2-oxidanyl-3-(4-oxidanyl-4-phenyl-piperidin-1-yl)propoxy]-4,5,6,7-tetrahydro-1H-indole-2-carboxylic acid

Systemtic Name: 3-[2-oxidanyl-3-(4-oxidanyl-4-phenyl-piperidin-1-yl)propoxy]-4,5,6,7-tetrahydro-1H-indole-2-carboxylic acid Openeye Name: 3-[2-hydroxy-3-(4-hydroxy-4-phenyl-1-piperidyl)propoxy]-4,5,6,7-tetrahydro-1H-indole-2-carboxylic acid CAS Name: 3-[2-hydroxy-3-(4-hydroxy-4-phenyl-1-piperidinyl)propoxy]-4,5,6,7-tetrahydro-1H-indole-2-carboxylic acid IUPAC Name: 3-[2-hydroxy-3-(4-hydroxy-4-phenylpiperidin-1-yl)propoxy]-4,5,6,7-tetrahydro-1H-indole-2-carboxylic acid Traditional Name: 3-[2-hydroxy-3-(4-hydroxy-4-phenyl-piperidino)propoxy]-4,5,6,7-tetrahydro-1H-indole-2-carboxylic acid Formula: C23H30N2O5 MolecularWeight: 414.4947

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(N2)C(=O)O)OCC(CN3CCC(CC3)(C4=CC=CC=C4)O)O

Isomeric SMILES

C1CCC2=C(C1)C(=C(N2)C(=O)O)OCC(CN3CCC(CC3)(C4=CC=CC=C4)O)O

InChI

InChI=1S/C23H30N2O5/c26-17(14-25-12-10-23(29,11-13-25)16-6-2-1-3-7-16)15-30-21-18-8-4-5-9-19(18)24-20(21)22(27)28/h1-3,6-7,17,24,26,29H,4-5,8-15H2,(H,27,28)