tert-butyl 4-[[3-(3-methoxy-3-oxidanylidene-propyl)phenyl]methyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[3-(3-methoxy-3-oxidanylidene-propyl)phenyl]methyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[3-(3-methoxy-3-oxo-propyl)phenyl]methyl]piperidine-1-carboxylate CAS Name: 4-[[3-(3-methoxy-3-oxopropyl)phenyl]methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[3-(3-methoxy-3-oxopropyl)phenyl]methyl]piperidine-1-carboxylate Traditional Name: 4-[3-(3-keto-3-methoxy-propyl)benzyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C21H31NO4 MolecularWeight: 361.47514

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)CC2=CC(=CC=C2)CCC(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)CC2=CC(=CC=C2)CCC(=O)OC

InChI

InChI=1S/C21H31NO4/c1-21(2,3)26-20(24)22-12-10-17(11-13-22)15-18-7-5-6-16(14-18)8-9-19(23)25-4/h5-7,14,17H,8-13,15H2,1-4H3