methyl 5-[(E)-3-[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-3-oxidanylidene-prop-1-enyl]-2-methyl-furan-3-carboxylate

Systemtic Name: methyl 5-[(E)-3-[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-3-oxidanylidene-prop-1-enyl]-2-methyl-furan-3-carboxylate Openeye Name: methyl 5-[(E)-3-[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-3-oxo-prop-1-enyl]-2-methyl-furan-3-carboxylate CAS Name: 5-[(E)-3-[4-(2-chlorophenyl)sulfonyl-1-piperazinyl]-3-oxoprop-1-enyl]-2-methyl-3-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[(E)-3-[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-3-oxoprop-1-enyl]-2-methylfuran-3-carboxylate Traditional Name: 5-[(E)-3-[4-(2-chlorophenyl)sulfonylpiperazino]-3-keto-prop-1-enyl]-2-methyl-furan-3-carboxylic acid methyl ester Formula: C20H21ClN2O6S MolecularWeight: 452.90854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)C=CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3Cl)C(=O)OC

Isomeric SMILES

CC1=C(C=C(O1)/C=C/C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3Cl)C(=O)OC

InChI

InChI=1S/C20H21ClN2O6S/c1-14-16(20(25)28-2)13-15(29-14)7-8-19(24)22-9-11-23(12-10-22)30(26,27)18-6-4-3-5-17(18)21/h3-8,13H,9-12H2,1-2H3/b8-7+