6-[4-(3-chloranyl-4-methyl-phenyl)piperazin-1-yl]sulfonyl-3,4-dihydrochromen-2-one

Systemtic Name: 6-[4-(3-chloranyl-4-methyl-phenyl)piperazin-1-yl]sulfonyl-3,4-dihydrochromen-2-one Openeye Name: 6-[4-(3-chloro-4-methyl-phenyl)piperazin-1-yl]sulfonylchroman-2-one CAS Name: 6-[[4-(3-chloro-4-methylphenyl)-1-piperazinyl]sulfonyl]-3,4-dihydro-2H-1-benzopyran-2-one IUPAC Name: 6-[4-(3-chloro-4-methylphenyl)piperazin-1-yl]sulfonyl-3,4-dihydrochromen-2-one Traditional Name: 6-[4-(3-chloro-4-methyl-phenyl)piperazino]sulfonylchroman-2-one Formula: C20H21ClN2O4S MolecularWeight: 420.90974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OC(=O)CC4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OC(=O)CC4)Cl

InChI

InChI=1S/C20H21ClN2O4S/c1-14-2-4-16(13-18(14)21)22-8-10-23(11-9-22)28(25,26)17-5-6-19-15(12-17)3-7-20(24)27-19/h2,4-6,12-13H,3,7-11H2,1H3