ethyl 4-[[4-[4-(4-tert-butylphenyl)carbonylpiperazin-1-yl]phenyl]carbamoylamino]benzoate

Systemtic Name: ethyl 4-[[4-[4-(4-tert-butylphenyl)carbonylpiperazin-1-yl]phenyl]carbamoylamino]benzoate Openeye Name: ethyl 4-[[4-[4-(4-tert-butylbenzoyl)piperazin-1-yl]phenyl]carbamoylamino]benzoate CAS Name: 4-[[[4-[4-[(4-tert-butylphenyl)-oxomethyl]-1-piperazinyl]anilino]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[4-[4-(4-tert-butylbenzoyl)piperazin-1-yl]phenyl]carbamoylamino]benzoate Traditional Name: 4-[[4-[4-(4-tert-butylbenzoyl)piperazino]phenyl]carbamoylamino]benzoic acid ethyl ester Formula: C31H36N4O4 MolecularWeight: 528.64194

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C31H36N4O4/c1-5-39-29(37)23-8-12-25(13-9-23)32-30(38)33-26-14-16-27(17-15-26)34-18-20-35(21-19-34)28(36)22-6-10-24(11-7-22)31(2,3)4/h6-17H,5,18-21H2,1-4H3,(H2,32,33,38)