tert-butyl 3-[(Z)-[4-oxidanyl-1-(triphenylmethyl)piperidin-3-ylidene]methyl]indole-1-carboxylate

Systemtic Name: tert-butyl 3-[(Z)-[4-oxidanyl-1-(triphenylmethyl)piperidin-3-ylidene]methyl]indole-1-carboxylate Openeye Name: tert-butyl 3-[(Z)-(4-hydroxy-1-trityl-3-piperidylidene)methyl]indole-1-carboxylate CAS Name: 3-[(Z)-[4-hydroxy-1-(triphenylmethyl)-3-piperidinylidene]methyl]-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[(Z)-(4-hydroxy-1-tritylpiperidin-3-ylidene)methyl]indole-1-carboxylate Traditional Name: 3-[(Z)-(4-hydroxy-1-trityl-3-piperidylidene)methyl]indole-1-carboxylic acid tert-butyl ester Formula: C38H38N2O3 MolecularWeight: 570.71992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C(C2=CC=CC=C21)C=C3CN(CCC3O)C(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C(C2=CC=CC=C21)/C=C\3/CN(CCC3O)C(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C38H38N2O3/c1-37(2,3)43-36(42)40-27-28(33-21-13-14-22-34(33)40)25-29-26-39(24-23-35(29)41)38(30-15-7-4-8-16-30,31-17-9-5-10-18-31)32-19-11-6-12-20-32/h4-22,25,27,35,41H,23-24,26H2,1-3H3/b29-25-