dimethyl 5-[[1-(1,3-benzoxazol-2-yl)piperidin-4-yl]carbonylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[[1-(1,3-benzoxazol-2-yl)piperidin-4-yl]carbonylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[1-(1,3-benzoxazol-2-yl)piperidine-4-carbonyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[[1-(1,3-benzoxazol-2-yl)-4-piperidinyl]-oxomethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[1-(1,3-benzoxazol-2-yl)piperidine-4-carbonyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[1-(1,3-benzoxazol-2-yl)isonipecotoyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C23H23N3O6 MolecularWeight: 437.44522

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)C2CCN(CC2)C3=NC4=CC=CC=C4O3)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)C2CCN(CC2)C3=NC4=CC=CC=C4O3)C(=O)OC

InChI

InChI=1S/C23H23N3O6/c1-30-21(28)15-11-16(22(29)31-2)13-17(12-15)24-20(27)14-7-9-26(10-8-14)23-25-18-5-3-4-6-19(18)32-23/h3-6,11-14H,7-10H2,1-2H3,(H,24,27)