6-chloranyl-4-ethyl-8-[[(2-methyl-1-oxidanyl-propan-2-yl)amino]methyl]-7-oxidanyl-chromen-2-one

Systemtic Name: 6-chloranyl-4-ethyl-8-[[(2-methyl-1-oxidanyl-propan-2-yl)amino]methyl]-7-oxidanyl-chromen-2-one Openeye Name: 6-chloro-4-ethyl-7-hydroxy-8-[[(2-hydroxy-1,1-dimethyl-ethyl)amino]methyl]chromen-2-one CAS Name: 6-chloro-4-ethyl-7-hydroxy-8-[[(1-hydroxy-2-methylpropan-2-yl)amino]methyl]-1-benzopyran-2-one IUPAC Name: 6-chloro-4-ethyl-7-hydroxy-8-[[(1-hydroxy-2-methylpropan-2-yl)amino]methyl]chromen-2-one Traditional Name: 6-chloro-4-ethyl-7-hydroxy-8-[[(2-hydroxy-1,1-dimethyl-ethyl)amino]methyl]coumarin Formula: C16H20ClNO4 MolecularWeight: 325.7873

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)OC2=C(C(=C(C=C12)Cl)O)CNC(C)(C)CO

Isomeric SMILES

CCC1=CC(=O)OC2=C(C(=C(C=C12)Cl)O)CNC(C)(C)CO

InChI

InChI=1S/C16H20ClNO4/c1-4-9-5-13(20)22-15-10(9)6-12(17)14(21)11(15)7-18-16(2,3)8-19/h5-6,18-19,21H,4,7-8H2,1-3H3