methyl 6-morpholin-4-yl-2-[(4-phenylphenyl)sulfonylamino]hex-4-ynoate

Systemtic Name: methyl 6-morpholin-4-yl-2-[(4-phenylphenyl)sulfonylamino]hex-4-ynoate Openeye Name: methyl 6-morpholino-2-[(4-phenylphenyl)sulfonylamino]hex-4-ynoate CAS Name: 6-(4-morpholinyl)-2-[(4-phenylphenyl)sulfonylamino]-4-hexynoic acid methyl ester IUPAC Name: methyl 6-morpholin-4-yl-2-[(4-phenylphenyl)sulfonylamino]hex-4-ynoate Traditional Name: 6-morpholino-2-[(4-phenylphenyl)sulfonylamino]hex-4-ynoic acid methyl ester Formula: C23H26N2O5S MolecularWeight: 442.52794

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC#CCN1CCOCC1)NS(=O)(=O)C2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C(CC#CCN1CCOCC1)NS(=O)(=O)C2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C23H26N2O5S/c1-29-23(26)22(9-5-6-14-25-15-17-30-18-16-25)24-31(27,28)21-12-10-20(11-13-21)19-7-3-2-4-8-19/h2-4,7-8,10-13,22,24H,9,14-18H2,1H3