2-[2-(decylamino)phenyl]carbonylpropanedioate

Systemtic Name: 2-[2-(decylamino)phenyl]carbonylpropanedioate Openeye Name: 2-[2-(decylamino)benzoyl]propanedioate CAS Name: 2-[[2-(decylamino)phenyl]-oxomethyl]propanedioate IUPAC Name: 2-[2-(decylamino)benzoyl]propanedioate Traditional Name: 2-[2-(decylamino)benzoyl]malonate Formula: C20H27NO5-2 MolecularWeight: 361.43208

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCNC1=CC=CC=C1C(=O)C(C(=O)[O-])C(=O)[O-]

Isomeric SMILES

CCCCCCCCCCNC1=CC=CC=C1C(=O)C(C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C20H29NO5/c1-2-3-4-5-6-7-8-11-14-21-16-13-10-9-12-15(16)18(22)17(19(23)24)20(25)26/h9-10,12-13,17,21H,2-8,11,14H2,1H3,(H,23,24)(H,25,26)/p-2