ethyl 3-[2-(4-tert-butylphenoxy)ethanoylamino]-4-(4-ethylpiperazin-1-yl)benzoate

Systemtic Name: ethyl 3-[2-(4-tert-butylphenoxy)ethanoylamino]-4-(4-ethylpiperazin-1-yl)benzoate Openeye Name: ethyl 3-[[2-(4-tert-butylphenoxy)acetyl]amino]-4-(4-ethylpiperazin-1-yl)benzoate CAS Name: 3-[[2-(4-tert-butylphenoxy)-1-oxoethyl]amino]-4-(4-ethyl-1-piperazinyl)benzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-(4-tert-butylphenoxy)acetyl]amino]-4-(4-ethylpiperazin-1-yl)benzoate Traditional Name: 3-[[2-(4-tert-butylphenoxy)acetyl]amino]-4-(4-ethylpiperazino)benzoic acid ethyl ester Formula: C27H37N3O4 MolecularWeight: 467.60038

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OCC)NC(=O)COC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OCC)NC(=O)COC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C27H37N3O4/c1-6-29-14-16-30(17-15-29)24-13-8-20(26(32)33-7-2)18-23(24)28-25(31)19-34-22-11-9-21(10-12-22)27(3,4)5/h8-13,18H,6-7,14-17,19H2,1-5H3,(H,28,31)