2-[2-(nonylamino)phenyl]carbonylpropanedioate

Systemtic Name: 2-[2-(nonylamino)phenyl]carbonylpropanedioate Openeye Name: 2-[2-(nonylamino)benzoyl]propanedioate CAS Name: 2-[[2-(nonylamino)phenyl]-oxomethyl]propanedioate IUPAC Name: 2-[2-(nonylamino)benzoyl]propanedioate Traditional Name: 2-[2-(nonylamino)benzoyl]malonate Formula: C19H25NO5-2 MolecularWeight: 347.4055

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCNC1=CC=CC=C1C(=O)C(C(=O)[O-])C(=O)[O-]

Isomeric SMILES

CCCCCCCCCNC1=CC=CC=C1C(=O)C(C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C19H27NO5/c1-2-3-4-5-6-7-10-13-20-15-12-9-8-11-14(15)17(21)16(18(22)23)19(24)25/h8-9,11-12,16,20H,2-7,10,13H2,1H3,(H,22,23)(H,24,25)/p-2