7-methoxy-4-[[(4-pyrrolidin-1-ylsulfonylphenyl)amino]methyl]chromen-2-one

Systemtic Name: 7-methoxy-4-[[(4-pyrrolidin-1-ylsulfonylphenyl)amino]methyl]chromen-2-one Openeye Name: 7-methoxy-4-[(4-pyrrolidin-1-ylsulfonylanilino)methyl]chromen-2-one CAS Name: 7-methoxy-4-[[4-(1-pyrrolidinylsulfonyl)anilino]methyl]-1-benzopyran-2-one IUPAC Name: 7-methoxy-4-[(4-pyrrolidin-1-ylsulfonylanilino)methyl]chromen-2-one Traditional Name: 7-methoxy-4-[(4-pyrrolidinosulfonylanilino)methyl]coumarin Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)CNC3=CC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)CNC3=CC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C21H22N2O5S/c1-27-17-6-9-19-15(12-21(24)28-20(19)13-17)14-22-16-4-7-18(8-5-16)29(25,26)23-10-2-3-11-23/h4-9,12-13,22H,2-3,10-11,14H2,1H3