tert-butyl 2-(2-oxidanylpropyl)-3-(3-phenylcarbazol-9-yl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 2-(2-oxidanylpropyl)-3-(3-phenylcarbazol-9-yl)piperazine-1-carboxylate Openeye Name: tert-butyl 2-(2-hydroxypropyl)-3-(3-phenylcarbazol-9-yl)piperazine-1-carboxylate CAS Name: 2-(2-hydroxypropyl)-3-(3-phenyl-9-carbazolyl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-(2-hydroxypropyl)-3-(3-phenylcarbazol-9-yl)piperazine-1-carboxylate Traditional Name: 2-(2-hydroxypropyl)-3-(3-phenylcarbazol-9-yl)piperazine-1-carboxylic acid tert-butyl ester Formula: C30H35N3O3 MolecularWeight: 485.6172

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1C(NCCN1C(=O)OC(C)(C)C)N2C3=C(C=C(C=C3)C4=CC=CC=C4)C5=CC=CC=C52)O

Isomeric SMILES

CC(CC1C(NCCN1C(=O)OC(C)(C)C)N2C3=C(C=C(C=C3)C4=CC=CC=C4)C5=CC=CC=C52)O

InChI

InChI=1S/C30H35N3O3/c1-20(34)18-27-28(31-16-17-32(27)29(35)36-30(2,3)4)33-25-13-9-8-12-23(25)24-19-22(14-15-26(24)33)21-10-6-5-7-11-21/h5-15,19-20,27-28,31,34H,16-18H2,1-4H3