[2-oxidanylidene-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)ethyl] 3-phenylsulfanylpropanoate

Systemtic Name: [2-oxidanylidene-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)ethyl] 3-phenylsulfanylpropanoate Openeye Name: [2-oxo-2-(tetralin-1-ylamino)ethyl] 3-phenylsulfanylpropanoate CAS Name: 3-(phenylthio)propanoic acid [2-oxo-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)ethyl] 3-phenylsulfanylpropanoate Traditional Name: 3-(phenylthio)propionic acid [2-keto-2-(tetralin-1-ylamino)ethyl] ester Formula: C21H23NO3S MolecularWeight: 369.47722

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=CC=CC=C2C1)NC(=O)COC(=O)CCSC3=CC=CC=C3

Isomeric SMILES

C1CC(C2=CC=CC=C2C1)NC(=O)COC(=O)CCSC3=CC=CC=C3

InChI

InChI=1S/C21H23NO3S/c23-20(22-19-12-6-8-16-7-4-5-11-18(16)19)15-25-21(24)13-14-26-17-9-2-1-3-10-17/h1-5,7,9-11,19H,6,8,12-15H2,(H,22,23)