ethyl 2-[(4-ethoxycarbonyl-4-phenyl-piperidin-1-yl)methyl]-5-oxidanyl-1-(phenylmethyl)indole-3-carboxylate

Systemtic Name: ethyl 2-[(4-ethoxycarbonyl-4-phenyl-piperidin-1-yl)methyl]-5-oxidanyl-1-(phenylmethyl)indole-3-carboxylate Openeye Name: ethyl 1-benzyl-2-[(4-ethoxycarbonyl-4-phenyl-1-piperidyl)methyl]-5-hydroxy-indole-3-carboxylate CAS Name: 2-[(4-ethoxycarbonyl-4-phenyl-1-piperidinyl)methyl]-5-hydroxy-1-(phenylmethyl)-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-2-[(4-ethoxycarbonyl-4-phenylpiperidin-1-yl)methyl]-5-hydroxyindole-3-carboxylate Traditional Name: 1-benzyl-2-[(4-carbethoxy-4-phenyl-piperidino)methyl]-5-hydroxy-indole-3-carboxylic acid ethyl ester Formula: C33H36N2O5 MolecularWeight: 540.64934

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)O)CC3=CC=CC=C3)CN4CCC(CC4)(C5=CC=CC=C5)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)O)CC3=CC=CC=C3)CN4CCC(CC4)(C5=CC=CC=C5)C(=O)OCC

InChI

InChI=1S/C33H36N2O5/c1-3-39-31(37)30-27-21-26(36)15-16-28(27)35(22-24-11-7-5-8-12-24)29(30)23-34-19-17-33(18-20-34,32(38)40-4-2)25-13-9-6-10-14-25/h5-16,21,36H,3-4,17-20,22-23H2,1-2H3