tert-butyl 4-[4-[4-[(2S)-2-azanyl-3-methoxy-3-oxidanylidene-propyl]phenoxy]butyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-[4-[(2S)-2-azanyl-3-methoxy-3-oxidanylidene-propyl]phenoxy]butyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-[4-[(2S)-2-amino-3-methoxy-3-oxo-propyl]phenoxy]butyl]piperidine-1-carboxylate CAS Name: 4-[4-[4-[(2S)-2-amino-3-methoxy-3-oxopropyl]phenoxy]butyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[4-[(2S)-2-amino-3-methoxy-3-oxopropyl]phenoxy]butyl]piperidine-1-carboxylate Traditional Name: 4-[4-[4-[(2S)-2-amino-3-keto-3-methoxy-propyl]phenoxy]butyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C24H38N2O5 MolecularWeight: 434.56892

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)CCCCOC2=CC=C(C=C2)CC(C(=O)OC)N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)CCCCOC2=CC=C(C=C2)C[C@@H](C(=O)OC)N

InChI

InChI=1S/C24H38N2O5/c1-24(2,3)31-23(28)26-14-12-18(13-15-26)7-5-6-16-30-20-10-8-19(9-11-20)17-21(25)22(27)29-4/h8-11,18,21H,5-7,12-17,25H2,1-4H3/t21-/m0/s1