2-[2-[ethyl(phenyl)amino]ethylsulfanyl]butanedioic acid

Systemtic Name: 2-[2-[ethyl(phenyl)amino]ethylsulfanyl]butanedioic acid Openeye Name: 2-[2-(N-ethylanilino)ethylsulfanyl]butanedioic acid CAS Name: 2-[2-(N-ethylanilino)ethylthio]butanedioic acid IUPAC Name: 2-[2-(N-ethylanilino)ethylsulfanyl]butanedioic acid Traditional Name: 2-[2-(N-ethylanilino)ethylthio]succinic acid Formula: C14H19NO4S MolecularWeight: 297.36996

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCSC(CC(=O)O)C(=O)O)C1=CC=CC=C1

Isomeric SMILES

CCN(CCSC(CC(=O)O)C(=O)O)C1=CC=CC=C1

InChI

InChI=1S/C14H19NO4S/c1-2-15(11-6-4-3-5-7-11)8-9-20-12(14(18)19)10-13(16)17/h3-7,12H,2,8-10H2,1H3,(H,16,17)(H,18,19)