ethyl (2S)-2-(pyren-1-ylsulfonylamino)propanoate

Systemtic Name: ethyl (2S)-2-(pyren-1-ylsulfonylamino)propanoate Openeye Name: ethyl (2S)-2-(pyren-1-ylsulfonylamino)propanoate CAS Name: (2S)-2-(1-pyrenylsulfonylamino)propanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-(pyren-1-ylsulfonylamino)propanoate Traditional Name: (2S)-2-(pyren-1-ylsulfonylamino)propionic acid ethyl ester Formula: C21H19NO4S MolecularWeight: 381.44486

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)NS(=O)(=O)C1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1

Isomeric SMILES

CCOC(=O)[C@H](C)NS(=O)(=O)C1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1

InChI

InChI=1S/C21H19NO4S/c1-3-26-21(23)13(2)22-27(24,25)18-12-10-16-8-7-14-5-4-6-15-9-11-17(18)20(16)19(14)15/h4-13,22H,3H2,1-2H3/t13-/m0/s1