ethyl 4-[[4-(4-octanoylpiperazin-1-yl)phenyl]carbamoylamino]benzoate

Systemtic Name: ethyl 4-[[4-(4-octanoylpiperazin-1-yl)phenyl]carbamoylamino]benzoate Openeye Name: ethyl 4-[[4-(4-octanoylpiperazin-1-yl)phenyl]carbamoylamino]benzoate CAS Name: 4-[[oxo-[4-[4-(1-oxooctyl)-1-piperazinyl]anilino]methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[4-(4-octanoylpiperazin-1-yl)phenyl]carbamoylamino]benzoate Traditional Name: 4-[[4-(4-caprylylpiperazino)phenyl]carbamoylamino]benzoic acid ethyl ester Formula: C28H38N4O4 MolecularWeight: 494.62572

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)NC3=CC=C(C=C3)C(=O)OCC

Isomeric SMILES

CCCCCCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)NC3=CC=C(C=C3)C(=O)OCC

InChI

InChI=1S/C28H38N4O4/c1-3-5-6-7-8-9-26(33)32-20-18-31(19-21-32)25-16-14-24(15-17-25)30-28(35)29-23-12-10-22(11-13-23)27(34)36-4-2/h10-17H,3-9,18-21H2,1-2H3,(H2,29,30,35)