3-[4-[(16-methoxy-16-oxidanylidene-hexadecyl)amino]phenyl]carbonyl-1,3-thiazolidine-4-carboxylic acid

Systemtic Name: 3-[4-[(16-methoxy-16-oxidanylidene-hexadecyl)amino]phenyl]carbonyl-1,3-thiazolidine-4-carboxylic acid Openeye Name: 3-[4-[(16-methoxy-16-oxo-hexadecyl)amino]benzoyl]thiazolidine-4-carboxylic acid CAS Name: 3-[[4-[(16-methoxy-16-oxohexadecyl)amino]phenyl]-oxomethyl]-4-thiazolidinecarboxylic acid IUPAC Name: 3-[4-[(16-methoxy-16-oxohexadecyl)amino]benzoyl]-1,3-thiazolidine-4-carboxylic acid Traditional Name: 3-[4-[(16-keto-16-methoxy-hexadecyl)amino]benzoyl]thiazolidine-4-carboxylic acid Formula: C28H44N2O5S MolecularWeight: 520.72436

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCCCCCCCCCCCNC1=CC=C(C=C1)C(=O)N2CSCC2C(=O)O

Isomeric SMILES

COC(=O)CCCCCCCCCCCCCCCNC1=CC=C(C=C1)C(=O)N2CSCC2C(=O)O

InChI

InChI=1S/C28H44N2O5S/c1-35-26(31)15-13-11-9-7-5-3-2-4-6-8-10-12-14-20-29-24-18-16-23(17-19-24)27(32)30-22-36-21-25(30)28(33)34/h16-19,25,29H,2-15,20-22H2,1H3,(H,33,34)