tert-butyl 4-[3-(4-cyclopropylcarbonylphenoxy)-3-phenyl-propyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[3-(4-cyclopropylcarbonylphenoxy)-3-phenyl-propyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[3-[4-(cyclopropanecarbonyl)phenoxy]-3-phenyl-propyl]piperazine-1-carboxylate CAS Name: 4-[3-[4-[cyclopropyl(oxo)methyl]phenoxy]-3-phenylpropyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-[4-(cyclopropanecarbonyl)phenoxy]-3-phenylpropyl]piperazine-1-carboxylate Traditional Name: 4-[3-[4-(cyclopropanecarbonyl)phenoxy]-3-phenyl-propyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C28H36N2O4 MolecularWeight: 464.59644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)CCC(C2=CC=CC=C2)OC3=CC=C(C=C3)C(=O)C4CC4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)CCC(C2=CC=CC=C2)OC3=CC=C(C=C3)C(=O)C4CC4

InChI

InChI=1S/C28H36N2O4/c1-28(2,3)34-27(32)30-19-17-29(18-20-30)16-15-25(21-7-5-4-6-8-21)33-24-13-11-23(12-14-24)26(31)22-9-10-22/h4-8,11-14,22,25H,9-10,15-20H2,1-3H3