methyl 4-[[(2-morpholin-4-ylpyridin-4-yl)methylcarbamoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[(2-morpholin-4-ylpyridin-4-yl)methylcarbamoylamino]methyl]benzoate Openeye Name: methyl 4-[[(2-morpholino-4-pyridyl)methylcarbamoylamino]methyl]benzoate CAS Name: 4-[[[[[2-(4-morpholinyl)-4-pyridinyl]methylamino]-oxomethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(2-morpholin-4-ylpyridin-4-yl)methylcarbamoylamino]methyl]benzoate Traditional Name: 4-[[(2-morpholino-4-pyridyl)methylcarbamoylamino]methyl]benzoic acid methyl ester Formula: C20H24N4O4 MolecularWeight: 384.42896

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)NCC2=CC(=NC=C2)N3CCOCC3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)NCC2=CC(=NC=C2)N3CCOCC3

InChI

InChI=1S/C20H24N4O4/c1-27-19(25)17-4-2-15(3-5-17)13-22-20(26)23-14-16-6-7-21-18(12-16)24-8-10-28-11-9-24/h2-7,12H,8-11,13-14H2,1H3,(H2,22,23,26)