6-methyl-3-[4-(phenylmethyl)piperidin-1-yl]sulfonyl-chromen-2-one

Systemtic Name: 6-methyl-3-[4-(phenylmethyl)piperidin-1-yl]sulfonyl-chromen-2-one Openeye Name: 3-[(4-benzyl-1-piperidyl)sulfonyl]-6-methyl-chromen-2-one CAS Name: 6-methyl-3-[[4-(phenylmethyl)-1-piperidinyl]sulfonyl]-1-benzopyran-2-one IUPAC Name: 3-(4-benzylpiperidin-1-yl)sulfonyl-6-methylchromen-2-one Traditional Name: 3-(4-benzylpiperidino)sulfonyl-6-methyl-coumarin Formula: C22H23NO4S MolecularWeight: 397.48732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=O)C(=C2)S(=O)(=O)N3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=O)C(=C2)S(=O)(=O)N3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C22H23NO4S/c1-16-7-8-20-19(13-16)15-21(22(24)27-20)28(25,26)23-11-9-18(10-12-23)14-17-5-3-2-4-6-17/h2-8,13,15,18H,9-12,14H2,1H3