tert-butyl 2-[(4-oct-1-ynylphenyl)sulfonylamino]propanoate

Systemtic Name: tert-butyl 2-[(4-oct-1-ynylphenyl)sulfonylamino]propanoate Openeye Name: tert-butyl 2-[(4-oct-1-ynylphenyl)sulfonylamino]propanoate CAS Name: 2-[(4-oct-1-ynylphenyl)sulfonylamino]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(4-oct-1-ynylphenyl)sulfonylamino]propanoate Traditional Name: 2-[(4-oct-1-ynylphenyl)sulfonylamino]propionic acid tert-butyl ester Formula: C21H31NO4S MolecularWeight: 393.54014

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC#CC1=CC=C(C=C1)S(=O)(=O)NC(C)C(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCC#CC1=CC=C(C=C1)S(=O)(=O)NC(C)C(=O)OC(C)(C)C

InChI

InChI=1S/C21H31NO4S/c1-6-7-8-9-10-11-12-18-13-15-19(16-14-18)27(24,25)22-17(2)20(23)26-21(3,4)5/h13-17,22H,6-10H2,1-5H3