(7-oxidanylidene-7-phenylazanyl-heptyl)sulfanylmethyl 2,2-dimethylpropanoate

Systemtic Name: (7-oxidanylidene-7-phenylazanyl-heptyl)sulfanylmethyl 2,2-dimethylpropanoate Openeye Name: (7-anilino-7-oxo-heptyl)sulfanylmethyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [(7-anilino-7-oxoheptyl)thio]methyl ester IUPAC Name: (7-anilino-7-oxoheptyl)sulfanylmethyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [(7-anilino-7-keto-heptyl)thio]methyl ester Formula: C19H29NO3S MolecularWeight: 351.50346

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCSCCCCCCC(=O)NC1=CC=CC=C1

Isomeric SMILES

CC(C)(C)C(=O)OCSCCCCCCC(=O)NC1=CC=CC=C1

InChI

InChI=1S/C19H29NO3S/c1-19(2,3)18(22)23-15-24-14-10-5-4-9-13-17(21)20-16-11-7-6-8-12-16/h6-8,11-12H,4-5,9-10,13-15H2,1-3H3,(H,20,21)