3-(4-chlorophenyl)sulfonyl-4-(4-pyrrol-1-ylpiperidin-1-yl)but-3-en-2-one

Systemtic Name: 3-(4-chlorophenyl)sulfonyl-4-(4-pyrrol-1-ylpiperidin-1-yl)but-3-en-2-one Openeye Name: 3-(4-chlorophenyl)sulfonyl-4-(4-pyrrol-1-yl-1-piperidyl)but-3-en-2-one CAS Name: 3-(4-chlorophenyl)sulfonyl-4-[4-(1-pyrrolyl)-1-piperidinyl]-3-buten-2-one IUPAC Name: 3-(4-chlorophenyl)sulfonyl-4-(4-pyrrol-1-ylpiperidin-1-yl)but-3-en-2-one Traditional Name: 3-(4-chlorophenyl)sulfonyl-4-(4-pyrrol-1-ylpiperidino)but-3-en-2-one Formula: C19H21ClN2O3S MolecularWeight: 392.89964

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CN1CCC(CC1)N2C=CC=C2)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(=O)C(=CN1CCC(CC1)N2C=CC=C2)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H21ClN2O3S/c1-15(23)19(26(24,25)18-6-4-16(20)5-7-18)14-21-12-8-17(9-13-21)22-10-2-3-11-22/h2-7,10-11,14,17H,8-9,12-13H2,1H3