ethyl 4-[(octanoylamino)carbamoylamino]benzoate

Systemtic Name: ethyl 4-[(octanoylamino)carbamoylamino]benzoate Openeye Name: ethyl 4-[(octanoylamino)carbamoylamino]benzoate CAS Name: 4-[[oxo-(1-oxooctylhydrazo)methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(octanoylamino)carbamoylamino]benzoate Traditional Name: 4-[(caprylylamino)carbamoylamino]benzoic acid ethyl ester Formula: C18H27N3O4 MolecularWeight: 349.42468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NNC(=O)NC1=CC=C(C=C1)C(=O)OCC

Isomeric SMILES

CCCCCCCC(=O)NNC(=O)NC1=CC=C(C=C1)C(=O)OCC

InChI

InChI=1S/C18H27N3O4/c1-3-5-6-7-8-9-16(22)20-21-18(24)19-15-12-10-14(11-13-15)17(23)25-4-2/h10-13H,3-9H2,1-2H3,(H,20,22)(H2,19,21,24)