7-methoxy-4-[[methyl-[1-(4-methylsulfonylphenyl)ethyl]amino]methyl]chromen-2-one

Systemtic Name: 7-methoxy-4-[[methyl-[1-(4-methylsulfonylphenyl)ethyl]amino]methyl]chromen-2-one Openeye Name: 7-methoxy-4-[[methyl-[1-(4-methylsulfonylphenyl)ethyl]amino]methyl]chromen-2-one CAS Name: 7-methoxy-4-[[methyl-[1-(4-methylsulfonylphenyl)ethyl]amino]methyl]-1-benzopyran-2-one IUPAC Name: 7-methoxy-4-[[methyl-[1-(4-methylsulfonylphenyl)ethyl]amino]methyl]chromen-2-one Traditional Name: 4-[[1-(4-mesylphenyl)ethyl-methyl-amino]methyl]-7-methoxy-coumarin Formula: C21H23NO5S MolecularWeight: 401.47602

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)S(=O)(=O)C)N(C)CC2=CC(=O)OC3=C2C=CC(=C3)OC

Isomeric SMILES

CC(C1=CC=C(C=C1)S(=O)(=O)C)N(C)CC2=CC(=O)OC3=C2C=CC(=C3)OC

InChI

InChI=1S/C21H23NO5S/c1-14(15-5-8-18(9-6-15)28(4,24)25)22(2)13-16-11-21(23)27-20-12-17(26-3)7-10-19(16)20/h5-12,14H,13H2,1-4H3