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

Systemtic Name: dimethyl 5-[[1-[(3-ethoxyphenyl)methyl]piperidin-4-yl]carbonylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[1-[(3-ethoxyphenyl)methyl]piperidine-4-carbonyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[[1-[(3-ethoxyphenyl)methyl]-4-piperidinyl]-oxomethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[1-[(3-ethoxyphenyl)methyl]piperidine-4-carbonyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[1-(3-ethoxybenzyl)isonipecotoyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C25H30N2O6 MolecularWeight: 454.5155

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)CN2CCC(CC2)C(=O)NC3=CC(=CC(=C3)C(=O)OC)C(=O)OC

Isomeric SMILES

CCOC1=CC=CC(=C1)CN2CCC(CC2)C(=O)NC3=CC(=CC(=C3)C(=O)OC)C(=O)OC

InChI

InChI=1S/C25H30N2O6/c1-4-33-22-7-5-6-17(12-22)16-27-10-8-18(9-11-27)23(28)26-21-14-19(24(29)31-2)13-20(15-21)25(30)32-3/h5-7,12-15,18H,4,8-11,16H2,1-3H3,(H,26,28)