[4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)carbonylphenyl] 1-carbamimidoylpiperidine-4-carboxylate

Systemtic Name: [4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)carbonylphenyl] 1-carbamimidoylpiperidine-4-carboxylate Openeye Name: [4-(2-morpholino-2-oxo-ethoxy)carbonylphenyl] 1-carbamimidoylpiperidine-4-carboxylate CAS Name: 1-carbamimidoyl-4-piperidinecarboxylic acid [4-[[2-(4-morpholinyl)-2-oxoethoxy]-oxomethyl]phenyl] ester IUPAC Name: [4-(2-morpholin-4-yl-2-oxoethoxy)carbonylphenyl] 1-carbamimidoylpiperidine-4-carboxylate Traditional Name: 1-amidinoisonipecotic acid [4-(2-keto-2-morpholino-ethoxy)carbonylphenyl] ester Formula: C20H26N4O6 MolecularWeight: 418.44364

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OC2=CC=C(C=C2)C(=O)OCC(=O)N3CCOCC3)C(=N)N

Isomeric SMILES

C1CN(CCC1C(=O)OC2=CC=C(C=C2)C(=O)OCC(=O)N3CCOCC3)C(=N)N

InChI

InChI=1S/C20H26N4O6/c21-20(22)24-7-5-15(6-8-24)19(27)30-16-3-1-14(2-4-16)18(26)29-13-17(25)23-9-11-28-12-10-23/h1-4,15H,5-13H2,(H3,21,22)