4-[(2-methylpropylamino)methyl]-7-oxidanyl-chromen-2-one

Systemtic Name: 4-[(2-methylpropylamino)methyl]-7-oxidanyl-chromen-2-one Openeye Name: 7-hydroxy-4-[(isobutylamino)methyl]chromen-2-one CAS Name: 7-hydroxy-4-[(2-methylpropylamino)methyl]-1-benzopyran-2-one IUPAC Name: 7-hydroxy-4-[(2-methylpropylamino)methyl]chromen-2-one Traditional Name: 7-hydroxy-4-[(isobutylamino)methyl]coumarin Formula: C14H17NO3 MolecularWeight: 247.28968

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNCC1=CC(=O)OC2=C1C=CC(=C2)O

Isomeric SMILES

CC(C)CNCC1=CC(=O)OC2=C1C=CC(=C2)O

InChI

InChI=1S/C14H17NO3/c1-9(2)7-15-8-10-5-14(17)18-13-6-11(16)3-4-12(10)13/h3-6,9,15-16H,7-8H2,1-2H3