ethyl 2-oxidanyl-5-[1-oxidanyl-5-(4-phenylpiperazin-1-yl)pentyl]benzoate

Systemtic Name: ethyl 2-oxidanyl-5-[1-oxidanyl-5-(4-phenylpiperazin-1-yl)pentyl]benzoate Openeye Name: ethyl 2-hydroxy-5-[1-hydroxy-5-(4-phenylpiperazin-1-yl)pentyl]benzoate CAS Name: 2-hydroxy-5-[1-hydroxy-5-(4-phenyl-1-piperazinyl)pentyl]benzoic acid ethyl ester IUPAC Name: ethyl 2-hydroxy-5-[1-hydroxy-5-(4-phenylpiperazin-1-yl)pentyl]benzoate Traditional Name: 2-hydroxy-5-[1-hydroxy-5-(4-phenylpiperazino)pentyl]benzoic acid ethyl ester Formula: C24H32N2O4 MolecularWeight: 412.52188

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CC(=C1)C(CCCCN2CCN(CC2)C3=CC=CC=C3)O)O

Isomeric SMILES

CCOC(=O)C1=C(C=CC(=C1)C(CCCCN2CCN(CC2)C3=CC=CC=C3)O)O

InChI

InChI=1S/C24H32N2O4/c1-2-30-24(29)21-18-19(11-12-23(21)28)22(27)10-6-7-13-25-14-16-26(17-15-25)20-8-4-3-5-9-20/h3-5,8-9,11-12,18,22,27-28H,2,6-7,10,13-17H2,1H3