tert-butyl 4-[[4-(diethylcarbamoyl)phenyl]-phenyl-methylidene]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[4-(diethylcarbamoyl)phenyl]-phenyl-methylidene]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[4-(diethylcarbamoyl)phenyl]-phenyl-methylene]piperidine-1-carboxylate CAS Name: 4-[[4-[diethylamino(oxo)methyl]phenyl]-phenylmethylidene]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[4-(diethylcarbamoyl)phenyl]-phenylmethylidene]piperidine-1-carboxylate Traditional Name: 4-[[4-(diethylcarbamoyl)phenyl]-phenyl-methylene]piperidine-1-carboxylic acid tert-butyl ester Formula: C28H36N2O3 MolecularWeight: 450.589582

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)C(=C2CCN(CC2)C(=O)OC(C)(C)C)C3=CC=CC=C3

Isomeric SMILES

CCN(CC)[14C](=O)C1=CC=C(C=C1)C(=C2CCN(CC2)C(=O)OC(C)(C)C)C3=CC=CC=C3

InChI

InChI=1S/C28H36N2O3/c1-6-29(7-2)26(31)24-15-13-22(14-16-24)25(21-11-9-8-10-12-21)23-17-19-30(20-18-23)27(32)33-28(3,4)5/h8-16H,6-7,17-20H2,1-5H3/i26+2