(2-oxidanylidene-4-propyl-chromen-7-yl) 1-(5-methylthiophen-2-yl)sulfonylpiperidine-3-carboxylate

Systemtic Name: (2-oxidanylidene-4-propyl-chromen-7-yl) 1-(5-methylthiophen-2-yl)sulfonylpiperidine-3-carboxylate Openeye Name: (2-oxo-4-propyl-chromen-7-yl) 1-[(5-methyl-2-thienyl)sulfonyl]piperidine-3-carboxylate CAS Name: 1-[(5-methyl-2-thiophenyl)sulfonyl]-3-piperidinecarboxylic acid (2-oxo-4-propyl-1-benzopyran-7-yl) ester IUPAC Name: (2-oxo-4-propylchromen-7-yl) 1-(5-methylthiophen-2-yl)sulfonylpiperidine-3-carboxylate Traditional Name: 1-[(5-methyl-2-thienyl)sulfonyl]nipecotic acid (2-keto-4-propyl-chromen-7-yl) ester Formula: C23H25NO6S2 MolecularWeight: 475.5777

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)C3CCCN(C3)S(=O)(=O)C4=CC=C(S4)C

Isomeric SMILES

CCCC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)C3CCCN(C3)S(=O)(=O)C4=CC=C(S4)C

InChI

InChI=1S/C23H25NO6S2/c1-3-5-16-12-21(25)30-20-13-18(8-9-19(16)20)29-23(26)17-6-4-11-24(14-17)32(27,28)22-10-7-15(2)31-22/h7-10,12-13,17H,3-6,11,14H2,1-2H3