ethyl 2-methyl-3-[4-(2-piperidin-1-ylethoxy)phenyl]-2-thiophen-2-ylsulfonyl-propanoate

Systemtic Name: ethyl 2-methyl-3-[4-(2-piperidin-1-ylethoxy)phenyl]-2-thiophen-2-ylsulfonyl-propanoate Openeye Name: ethyl 2-methyl-3-[4-[2-(1-piperidyl)ethoxy]phenyl]-2-(2-thienylsulfonyl)propanoate CAS Name: 2-methyl-3-[4-[2-(1-piperidinyl)ethoxy]phenyl]-2-thiophen-2-ylsulfonylpropanoic acid ethyl ester IUPAC Name: ethyl 2-methyl-3-[4-(2-piperidin-1-ylethoxy)phenyl]-2-thiophen-2-ylsulfonylpropanoate Traditional Name: 2-methyl-3-[4-(2-piperidinoethoxy)phenyl]-2-(2-thienylsulfonyl)propionic acid ethyl ester Formula: C23H31NO5S2 MolecularWeight: 465.62594

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(CC1=CC=C(C=C1)OCCN2CCCCC2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CCOC(=O)C(C)(CC1=CC=C(C=C1)OCCN2CCCCC2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C23H31NO5S2/c1-3-28-22(25)23(2,31(26,27)21-8-7-17-30-21)18-19-9-11-20(12-10-19)29-16-15-24-13-5-4-6-14-24/h7-12,17H,3-6,13-16,18H2,1-2H3