[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl] 4-butoxybenzoate

Systemtic Name: [2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl] 4-butoxybenzoate Openeye Name: [2-oxo-2-(4-phenylpiperazin-1-yl)ethyl] 4-butoxybenzoate CAS Name: 4-butoxybenzoic acid [2-oxo-2-(4-phenyl-1-piperazinyl)ethyl] ester IUPAC Name: [2-oxo-2-(4-phenylpiperazin-1-yl)ethyl] 4-butoxybenzoate Traditional Name: 4-butoxybenzoic acid [2-keto-2-(4-phenylpiperazino)ethyl] ester Formula: C23H28N2O4 MolecularWeight: 396.47942

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)OCC(=O)N2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)OCC(=O)N2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C23H28N2O4/c1-2-3-17-28-21-11-9-19(10-12-21)23(27)29-18-22(26)25-15-13-24(14-16-25)20-7-5-4-6-8-20/h4-12H,2-3,13-18H2,1H3