5-[2-[(2-ethenylphenyl)methylsulfanyl]ethylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[2-[(2-ethenylphenyl)methylsulfanyl]ethylamino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-oxo-5-[2-[(2-vinylphenyl)methylsulfanyl]ethylamino]pentanoic acid CAS Name: 5-[2-[(2-ethenylphenyl)methylthio]ethylamino]-5-oxopentanoic acid IUPAC Name: 5-[2-[(2-ethenylphenyl)methylsulfanyl]ethylamino]-5-oxopentanoic acid Traditional Name: 5-keto-5-[2-[(2-vinylbenzyl)thio]ethylamino]valeric acid Formula: C16H21NO3S MolecularWeight: 307.40784

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Descriptors Computed from Structure

Canonical SMILES:

C=CC1=CC=CC=C1CSCCNC(=O)CCCC(=O)O

Isomeric SMILES

C=CC1=CC=CC=C1CSCCNC(=O)CCCC(=O)O

InChI

InChI=1S/C16H21NO3S/c1-2-13-6-3-4-7-14(13)12-21-11-10-17-15(18)8-5-9-16(19)20/h2-4,6-7H,1,5,8-12H2,(H,17,18)(H,19,20)