3-[(4-piperidin-1-ylsulfonylphenyl)iminomethyl]chromen-4-one

Systemtic Name: 3-[(4-piperidin-1-ylsulfonylphenyl)iminomethyl]chromen-4-one Openeye Name: 3-[[4-(1-piperidylsulfonyl)phenyl]iminomethyl]chromen-4-one CAS Name: 3-[[4-(1-piperidinylsulfonyl)phenyl]iminomethyl]-1-benzopyran-4-one IUPAC Name: 3-[(4-piperidin-1-ylsulfonylphenyl)iminomethyl]chromen-4-one Traditional Name: 3-[(4-piperidinosulfonylphenyl)iminomethyl]chromone Formula: C21H20N2O4S MolecularWeight: 396.4595

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)N=CC3=COC4=CC=CC=C4C3=O

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)N=CC3=COC4=CC=CC=C4C3=O

InChI

InChI=1S/C21H20N2O4S/c24-21-16(15-27-20-7-3-2-6-19(20)21)14-22-17-8-10-18(11-9-17)28(25,26)23-12-4-1-5-13-23/h2-3,6-11,14-15H,1,4-5,12-13H2