tert-butyl 4-[2-[[3,3-diphenylpropyl-[1-[(3,4,5-trimethoxyphenyl)amino]ethenyl]amino]methyl]prop-2-enyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-[[3,3-diphenylpropyl-[1-[(3,4,5-trimethoxyphenyl)amino]ethenyl]amino]methyl]prop-2-enyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[2-[[3,3-diphenylpropyl-[1-(3,4,5-trimethoxyanilino)vinyl]amino]methyl]allyl]piperazine-1-carboxylate CAS Name: 4-[2-[[3,3-diphenylpropyl-[1-(3,4,5-trimethoxyanilino)ethenyl]amino]methyl]prop-2-enyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-[[3,3-diphenylpropyl-[1-(3,4,5-trimethoxyanilino)ethenyl]amino]methyl]prop-2-enyl]piperazine-1-carboxylate Traditional Name: 4-[2-[[3,3-diphenylpropyl-[1-(3,4,5-trimethoxyanilino)vinyl]amino]methyl]allyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C39H52N4O5 MolecularWeight: 656.85398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)CC(=C)CN(CCC(C2=CC=CC=C2)C3=CC=CC=C3)C(=C)NC4=CC(=C(C(=C4)OC)OC)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)CC(=C)CN(CCC(C2=CC=CC=C2)C3=CC=CC=C3)C(=C)NC4=CC(=C(C(=C4)OC)OC)OC

InChI

InChI=1S/C39H52N4O5/c1-29(27-41-21-23-42(24-22-41)38(44)48-39(3,4)5)28-43(30(2)40-33-25-35(45-6)37(47-8)36(26-33)46-7)20-19-34(31-15-11-9-12-16-31)32-17-13-10-14-18-32/h9-18,25-26,34,40H,1-2,19-24,27-28H2,3-8H3