6-bromanyl-4-(butylamino)-3-propyl-chromen-2-one

Systemtic Name: 6-bromanyl-4-(butylamino)-3-propyl-chromen-2-one Openeye Name: 6-bromo-4-(butylamino)-3-propyl-chromen-2-one CAS Name: 6-bromo-4-(butylamino)-3-propyl-1-benzopyran-2-one IUPAC Name: 6-bromo-4-(butylamino)-3-propylchromen-2-one Traditional Name: 6-bromo-4-(butylamino)-3-propyl-coumarin Formula: C16H20BrNO2 MolecularWeight: 338.2395

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C(=O)OC2=C1C=C(C=C2)Br)CCC

Isomeric SMILES

CCCCNC1=C(C(=O)OC2=C1C=C(C=C2)Br)CCC

InChI

InChI=1S/C16H20BrNO2/c1-3-5-9-18-15-12(6-4-2)16(19)20-14-8-7-11(17)10-13(14)15/h7-8,10,18H,3-6,9H2,1-2H3