4-[4-[4-(5-butylthiophen-2-yl)carbonylpiperidin-1-yl]phenyl]sulfonyl-1-(2-methoxyethyl)piperidine-4-carboxylic acid

Systemtic Name: 4-[4-[4-(5-butylthiophen-2-yl)carbonylpiperidin-1-yl]phenyl]sulfonyl-1-(2-methoxyethyl)piperidine-4-carboxylic acid Openeye Name: 4-[4-[4-(5-butylthiophene-2-carbonyl)-1-piperidyl]phenyl]sulfonyl-1-(2-methoxyethyl)piperidine-4-carboxylic acid CAS Name: 4-[4-[4-[(5-butyl-2-thiophenyl)-oxomethyl]-1-piperidinyl]phenyl]sulfonyl-1-(2-methoxyethyl)-4-piperidinecarboxylic acid IUPAC Name: 4-[4-[4-(5-butylthiophene-2-carbonyl)piperidin-1-yl]phenyl]sulfonyl-1-(2-methoxyethyl)piperidine-4-carboxylic acid Traditional Name: 4-[4-[4-(5-butylthiophene-2-carbonyl)piperidino]phenyl]sulfonyl-1-(2-methoxyethyl)isonipecotic acid Formula: C29H40N2O6S2 MolecularWeight: 576.7677

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(S1)C(=O)C2CCN(CC2)C3=CC=C(C=C3)S(=O)(=O)C4(CCN(CC4)CCOC)C(=O)O

Isomeric SMILES

CCCCC1=CC=C(S1)C(=O)C2CCN(CC2)C3=CC=C(C=C3)S(=O)(=O)C4(CCN(CC4)CCOC)C(=O)O

InChI

InChI=1S/C29H40N2O6S2/c1-3-4-5-24-8-11-26(38-24)27(32)22-12-16-31(17-13-22)23-6-9-25(10-7-23)39(35,36)29(28(33)34)14-18-30(19-15-29)20-21-37-2/h6-11,22H,3-5,12-21H2,1-2H3,(H,33,34)