methylamino 2-(4-but-2-ynoxyphenyl)sulfonyl-2-[1-(diethylamino)cyclohexyl]ethanoate

Systemtic Name: methylamino 2-(4-but-2-ynoxyphenyl)sulfonyl-2-[1-(diethylamino)cyclohexyl]ethanoate Openeye Name: methylamino 2-(4-but-2-ynoxyphenyl)sulfonyl-2-[1-(diethylamino)cyclohexyl]acetate CAS Name: 2-(4-but-2-ynoxyphenyl)sulfonyl-2-[1-(diethylamino)cyclohexyl]acetic acid methylamino ester IUPAC Name: methylamino 2-(4-but-2-ynoxyphenyl)sulfonyl-2-[1-(diethylamino)cyclohexyl]acetate Traditional Name: 2-(4-but-2-ynoxyphenyl)sulfonyl-2-[1-(diethylamino)cyclohexyl]acetic acid methylamino ester Formula: C23H34N2O5S MolecularWeight: 450.59146

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1(CCCCC1)C(C(=O)ONC)S(=O)(=O)C2=CC=C(C=C2)OCC#CC

Isomeric SMILES

CCN(CC)C1(CCCCC1)C(C(=O)ONC)S(=O)(=O)C2=CC=C(C=C2)OCC#CC

InChI

InChI=1S/C23H34N2O5S/c1-5-8-18-29-19-12-14-20(15-13-19)31(27,28)21(22(26)30-24-4)23(25(6-2)7-3)16-10-9-11-17-23/h12-15,21,24H,6-7,9-11,16-18H2,1-4H3