but-2-ynoxybenzene; piperidin-4-yl 2-(2-hydroxyethylsulfanyl)-2-(sulfonylamino)ethanoate

Systemtic Name: but-2-ynoxybenzene; piperidin-4-yl 2-(2-hydroxyethylsulfanyl)-2-(sulfonylamino)ethanoate Openeye Name: but-2-ynoxybenzene; 4-piperidyl 2-(2-hydroxyethylsulfanyl)-2-(sulfonylamino)acetate CAS Name: but-2-ynoxybenzene; 2-(2-hydroxyethylthio)-2-(sulfonylamino)acetic acid 4-piperidinyl ester IUPAC Name: but-2-ynoxybenzene; piperidin-4-yl 2-(2-hydroxyethylsulfanyl)-2-(sulfonylamino)acetate Traditional Name: but-2-ynoxybenzene; 2-(2-hydroxyethylthio)-2-(sulfonylamino)acetic acid 4-piperidyl ester Formula: C19H26N2O6S2 MolecularWeight: 442.54954

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=CC=C1.C1CNCCC1OC(=O)C(N=S(=O)=O)SCCO

Isomeric SMILES

CC#CCOC1=CC=CC=C1.C1CNCCC1OC(=O)C(N=S(=O)=O)SCCO

InChI

InChI=1S/C10H10O.C9H16N2O5S2/c1-2-3-9-11-10-7-5-4-6-8-10;12-5-6-17-8(11-18(14)15)9(13)16-7-1-3-10-4-2-7/h4-8H,9H2,1H3;7-8,10,12H,1-6H2