3-[4-[3-(2-phenylbutanoyloxy)propyl]piperazin-1-yl]propyl 2-phenylbutanoate

Systemtic Name: 3-[4-[3-(2-phenylbutanoyloxy)propyl]piperazin-1-yl]propyl 2-phenylbutanoate Openeye Name: 3-[4-[3-(2-phenylbutanoyloxy)propyl]piperazin-1-yl]propyl 2-phenylbutanoate CAS Name: 2-phenylbutanoic acid 3-[4-[3-(1-oxo-2-phenylbutoxy)propyl]-1-piperazinyl]propyl ester IUPAC Name: 3-[4-[3-(2-phenylbutanoyloxy)propyl]piperazin-1-yl]propyl 2-phenylbutanoate Traditional Name: 2-phenylbutyric acid 3-[4-[3-(2-phenylbutanoyloxy)propyl]piperazino]propyl ester Formula: C30H42N2O4 MolecularWeight: 494.66548

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)OCCCN2CCN(CC2)CCCOC(=O)C(CC)C3=CC=CC=C3

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)OCCCN2CCN(CC2)CCCOC(=O)C(CC)C3=CC=CC=C3

InChI

InChI=1S/C30H42N2O4/c1-3-27(25-13-7-5-8-14-25)29(33)35-23-11-17-31-19-21-32(22-20-31)18-12-24-36-30(34)28(4-2)26-15-9-6-10-16-26/h5-10,13-16,27-28H,3-4,11-12,17-24H2,1-2H3