tert-butyl 4-[2-(1-azanylethyl)-4-chloranyl-phenyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-(1-azanylethyl)-4-chloranyl-phenyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[2-(1-aminoethyl)-4-chloro-phenyl]piperidine-1-carboxylate CAS Name: 4-[2-(1-aminoethyl)-4-chlorophenyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-(1-aminoethyl)-4-chlorophenyl]piperidine-1-carboxylate Traditional Name: 4-[2-(1-aminoethyl)-4-chloro-phenyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C18H27ClN2O2 MolecularWeight: 338.87218

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=CC(=C1)Cl)C2CCN(CC2)C(=O)OC(C)(C)C)N

Isomeric SMILES

CC(C1=C(C=CC(=C1)Cl)C2CCN(CC2)C(=O)OC(C)(C)C)N

InChI

InChI=1S/C18H27ClN2O2/c1-12(20)16-11-14(19)5-6-15(16)13-7-9-21(10-8-13)17(22)23-18(2,3)4/h5-6,11-13H,7-10,20H2,1-4H3