ethyl 4-(4-ethylpiperazin-1-yl)-3-[[3-(2-methylpropoxy)phenyl]carbonylamino]benzoate

Systemtic Name: ethyl 4-(4-ethylpiperazin-1-yl)-3-[[3-(2-methylpropoxy)phenyl]carbonylamino]benzoate Openeye Name: ethyl 4-(4-ethylpiperazin-1-yl)-3-[(3-isobutoxybenzoyl)amino]benzoate CAS Name: 4-(4-ethyl-1-piperazinyl)-3-[[[3-(2-methylpropoxy)phenyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-(4-ethylpiperazin-1-yl)-3-[[3-(2-methylpropoxy)benzoyl]amino]benzoate Traditional Name: 4-(4-ethylpiperazino)-3-[(3-isobutoxybenzoyl)amino]benzoic acid ethyl ester Formula: C26H35N3O4 MolecularWeight: 453.5738

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OCC)NC(=O)C3=CC(=CC=C3)OCC(C)C

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OCC)NC(=O)C3=CC(=CC=C3)OCC(C)C

InChI

InChI=1S/C26H35N3O4/c1-5-28-12-14-29(15-13-28)24-11-10-21(26(31)32-6-2)17-23(24)27-25(30)20-8-7-9-22(16-20)33-18-19(3)4/h7-11,16-17,19H,5-6,12-15,18H2,1-4H3,(H,27,30)