ethyl 4-[[4-[4-(2-ethylbutanoyl)piperazin-1-yl]phenyl]carbamoylamino]benzoate

Systemtic Name: ethyl 4-[[4-[4-(2-ethylbutanoyl)piperazin-1-yl]phenyl]carbamoylamino]benzoate Openeye Name: ethyl 4-[[4-[4-(2-ethylbutanoyl)piperazin-1-yl]phenyl]carbamoylamino]benzoate CAS Name: 4-[[[4-[4-(2-ethyl-1-oxobutyl)-1-piperazinyl]anilino]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[4-[4-(2-ethylbutanoyl)piperazin-1-yl]phenyl]carbamoylamino]benzoate Traditional Name: 4-[[4-[4-(2-ethylbutanoyl)piperazino]phenyl]carbamoylamino]benzoic acid ethyl ester Formula: C26H34N4O4 MolecularWeight: 466.57256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H34N4O4/c1-4-19(5-2)24(31)30-17-15-29(16-18-30)23-13-11-22(12-14-23)28-26(33)27-21-9-7-20(8-10-21)25(32)34-6-3/h7-14,19H,4-6,15-18H2,1-3H3,(H2,27,28,33)