[2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 3-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)propanoate

Systemtic Name: [2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 3-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)propanoate Openeye Name: [2-(1-ethylpropylamino)-2-oxo-ethyl] 3-(tetralin-6-ylsulfonylamino)propanoate CAS Name: 3-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)propanoic acid [2-oxo-2-(pentan-3-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-3-ylamino)ethyl] 3-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)propanoate Traditional Name: 3-(tetralin-6-ylsulfonylamino)propionic acid [2-(1-ethylpropylamino)-2-keto-ethyl] ester Formula: C20H30N2O5S MolecularWeight: 410.5276

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)COC(=O)CCNS(=O)(=O)C1=CC2=C(CCCC2)C=C1

Isomeric SMILES

CCC(CC)NC(=O)COC(=O)CCNS(=O)(=O)C1=CC2=C(CCCC2)C=C1

InChI

InChI=1S/C20H30N2O5S/c1-3-17(4-2)22-19(23)14-27-20(24)11-12-21-28(25,26)18-10-9-15-7-5-6-8-16(15)13-18/h9-10,13,17,21H,3-8,11-12,14H2,1-2H3,(H,22,23)