8-[[bis(2-methylpropyl)amino]methyl]-6-ethyl-4-methyl-7-oxidanyl-chromen-2-one

Systemtic Name: 8-[[bis(2-methylpropyl)amino]methyl]-6-ethyl-4-methyl-7-oxidanyl-chromen-2-one Openeye Name: 8-[(diisobutylamino)methyl]-6-ethyl-7-hydroxy-4-methyl-chromen-2-one CAS Name: 8-[[bis(2-methylpropyl)amino]methyl]-6-ethyl-7-hydroxy-4-methyl-1-benzopyran-2-one IUPAC Name: 8-[[bis(2-methylpropyl)amino]methyl]-6-ethyl-7-hydroxy-4-methylchromen-2-one Traditional Name: 8-[(diisobutylamino)methyl]-6-ethyl-7-hydroxy-4-methyl-coumarin Formula: C21H31NO3 MolecularWeight: 345.47574

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C2C(=C1)C(=CC(=O)O2)C)CN(CC(C)C)CC(C)C)O

Isomeric SMILES

CCC1=C(C(=C2C(=C1)C(=CC(=O)O2)C)CN(CC(C)C)CC(C)C)O

InChI

InChI=1S/C21H31NO3/c1-7-16-9-17-15(6)8-19(23)25-21(17)18(20(16)24)12-22(10-13(2)3)11-14(4)5/h8-9,13-14,24H,7,10-12H2,1-6H3