4-[2-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]-1,3-thiazol-4-yl]benzoic acid

Systemtic Name: 4-[2-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]-1,3-thiazol-4-yl]benzoic acid Openeye Name: 4-[2-(4-tert-butoxycarbonylpiperazin-1-yl)thiazol-4-yl]benzoic acid CAS Name: 4-[2-[4-[(2-methylpropan-2-yl)oxy-oxomethyl]-1-piperazinyl]-4-thiazolyl]benzoic acid IUPAC Name: 4-[2-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]-1,3-thiazol-4-yl]benzoic acid Traditional Name: 4-[2-(4-tert-butoxycarbonylpiperazino)thiazol-4-yl]benzoic acid Formula: C19H23N3O4S MolecularWeight: 389.46862

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC(=CS2)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC(=CS2)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C19H23N3O4S/c1-19(2,3)26-18(25)22-10-8-21(9-11-22)17-20-15(12-27-17)13-4-6-14(7-5-13)16(23)24/h4-7,12H,8-11H2,1-3H3,(H,23,24)