3-oxidanylidene-2-[(triphenylmethyl)amino]butanoate

Systemtic Name: 3-oxidanylidene-2-[(triphenylmethyl)amino]butanoate Openeye Name: 3-oxo-2-(tritylamino)butanoate CAS Name: 3-oxo-2-[(triphenylmethyl)amino]butanoate IUPAC Name: 3-oxo-2-(tritylamino)butanoate Traditional Name: 3-keto-2-(tritylamino)butyrate Formula: C23H20NO3- MolecularWeight: 358.4098

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(=O)[O-])NC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(=O)C(C(=O)[O-])NC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C23H21NO3/c1-17(25)21(22(26)27)24-23(18-11-5-2-6-12-18,19-13-7-3-8-14-19)20-15-9-4-10-16-20/h2-16,21,24H,1H3,(H,26,27)/p-1