phenylmethoxymethyl N-[4-[3-(4-hexanoylphenoxy)propyl]piperazin-1-yl]-N-(2-oxidanylideneethyl)carbamate

Systemtic Name: phenylmethoxymethyl N-[4-[3-(4-hexanoylphenoxy)propyl]piperazin-1-yl]-N-(2-oxidanylideneethyl)carbamate Openeye Name: benzyloxymethyl N-[4-[3-(4-hexanoylphenoxy)propyl]piperazin-1-yl]-N-(2-oxoethyl)carbamate CAS Name: N-(2-oxoethyl)-N-[4-[3-[4-(1-oxohexyl)phenoxy]propyl]-1-piperazinyl]carbamic acid phenylmethoxymethyl ester IUPAC Name: phenylmethoxymethyl N-[4-[3-(4-hexanoylphenoxy)propyl]piperazin-1-yl]-N-(2-oxoethyl)carbamate Traditional Name: N-[4-[3-(4-caproylphenoxy)propyl]piperazino]-N-(2-ketoethyl)carbamic acid benzoxymethyl ester Formula: C30H41N3O6 MolecularWeight: 539.66304

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)C1=CC=C(C=C1)OCCCN2CCN(CC2)N(CC=O)C(=O)OCOCC3=CC=CC=C3

Isomeric SMILES

CCCCCC(=O)C1=CC=C(C=C1)OCCCN2CCN(CC2)N(CC=O)C(=O)OCOCC3=CC=CC=C3

InChI

InChI=1S/C30H41N3O6/c1-2-3-5-11-29(35)27-12-14-28(15-13-27)38-23-8-16-31-17-19-32(20-18-31)33(21-22-34)30(36)39-25-37-24-26-9-6-4-7-10-26/h4,6-7,9-10,12-15,22H,2-3,5,8,11,16-21,23-25H2,1H3