3-[4-(13,13-dimethyltetradecylamino)phenyl]-2-oxidanylidene-propanoic acid

Systemtic Name: 3-[4-(13,13-dimethyltetradecylamino)phenyl]-2-oxidanylidene-propanoic acid Openeye Name: 3-[4-(13,13-dimethyltetradecylamino)phenyl]-2-oxo-propanoic acid CAS Name: 3-[4-(13,13-dimethyltetradecylamino)phenyl]-2-oxopropanoic acid IUPAC Name: 3-[4-(13,13-dimethyltetradecylamino)phenyl]-2-oxopropanoic acid Traditional Name: 3-[4-(13,13-dimethyltetradecylamino)phenyl]-2-keto-propionic acid Formula: C25H41NO3 MolecularWeight: 403.59794

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CCCCCCCCCCCCNC1=CC=C(C=C1)CC(=O)C(=O)O

Isomeric SMILES

CC(C)(C)CCCCCCCCCCCCNC1=CC=C(C=C1)CC(=O)C(=O)O

InChI

InChI=1S/C25H41NO3/c1-25(2,3)18-12-10-8-6-4-5-7-9-11-13-19-26-22-16-14-21(15-17-22)20-23(27)24(28)29/h14-17,26H,4-13,18-20H2,1-3H3,(H,28,29)