(2-morpholin-4-yl-2-oxidanylidene-ethyl) 4-[[5-(4-carbamimidoylphenyl)-2-methoxy-phenyl]carbonylamino]cyclohexane-1-carboxylate

Systemtic Name: (2-morpholin-4-yl-2-oxidanylidene-ethyl) 4-[[5-(4-carbamimidoylphenyl)-2-methoxy-phenyl]carbonylamino]cyclohexane-1-carboxylate Openeye Name: (2-morpholino-2-oxo-ethyl) 4-[[5-(4-carbamimidoylphenyl)-2-methoxy-benzoyl]amino]cyclohexanecarboxylate CAS Name: 4-[[[5-(4-carbamimidoylphenyl)-2-methoxyphenyl]-oxomethyl]amino]-1-cyclohexanecarboxylic acid [2-(4-morpholinyl)-2-oxoethyl] ester IUPAC Name: (2-morpholin-4-yl-2-oxoethyl) 4-[[5-(4-carbamimidoylphenyl)-2-methoxybenzoyl]amino]cyclohexane-1-carboxylate Traditional Name: 4-[[5-(4-amidinophenyl)-2-methoxy-benzoyl]amino]cyclohexanecarboxylic acid (2-keto-2-morpholino-ethyl) ester Formula: C28H34N4O6 MolecularWeight: 522.59276

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC=C(C=C2)C(=N)N)C(=O)NC3CCC(CC3)C(=O)OCC(=O)N4CCOCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC=C(C=C2)C(=N)N)C(=O)NC3CCC(CC3)C(=O)OCC(=O)N4CCOCC4

InChI

InChI=1S/C28H34N4O6/c1-36-24-11-8-21(18-2-4-19(5-3-18)26(29)30)16-23(24)27(34)31-22-9-6-20(7-10-22)28(35)38-17-25(33)32-12-14-37-15-13-32/h2-5,8,11,16,20,22H,6-7,9-10,12-15,17H2,1H3,(H3,29,30)(H,31,34)