tert-butyl N-[2-[4-[3-(4-hexanoylphenoxy)propyl]piperazin-1-yl]-2-oxidanylidene-ethyl]-N-methyl-carbamate

Systemtic Name: tert-butyl N-[2-[4-[3-(4-hexanoylphenoxy)propyl]piperazin-1-yl]-2-oxidanylidene-ethyl]-N-methyl-carbamate Openeye Name: tert-butyl N-[2-[4-[3-(4-hexanoylphenoxy)propyl]piperazin-1-yl]-2-oxo-ethyl]-N-methyl-carbamate CAS Name: N-methyl-N-[2-oxo-2-[4-[3-[4-(1-oxohexyl)phenoxy]propyl]-1-piperazinyl]ethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-[4-[3-(4-hexanoylphenoxy)propyl]piperazin-1-yl]-2-oxoethyl]-N-methylcarbamate Traditional Name: N-[2-[4-[3-(4-caproylphenoxy)propyl]piperazino]-2-keto-ethyl]-N-methyl-carbamic acid tert-butyl ester Formula: C27H43N3O5 MolecularWeight: 489.64742

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)C1=CC=C(C=C1)OCCCN2CCN(CC2)C(=O)CN(C)C(=O)OC(C)(C)C

Isomeric SMILES

CCCCCC(=O)C1=CC=C(C=C1)OCCCN2CCN(CC2)C(=O)CN(C)C(=O)OC(C)(C)C

InChI

InChI=1S/C27H43N3O5/c1-6-7-8-10-24(31)22-11-13-23(14-12-22)34-20-9-15-29-16-18-30(19-17-29)25(32)21-28(5)26(33)35-27(2,3)4/h11-14H,6-10,15-21H2,1-5H3