6-bromanyl-3-[[(phenylmethyl)amino]methyl]chromen-2-one

Systemtic Name: 6-bromanyl-3-[[(phenylmethyl)amino]methyl]chromen-2-one Openeye Name: 3-[(benzylamino)methyl]-6-bromo-chromen-2-one CAS Name: 6-bromo-3-[[(phenylmethyl)amino]methyl]-1-benzopyran-2-one IUPAC Name: 3-[(benzylamino)methyl]-6-bromochromen-2-one Traditional Name: 3-[(benzylamino)methyl]-6-bromo-coumarin Formula: C17H14BrNO2 MolecularWeight: 344.20256

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNCC2=CC3=C(C=CC(=C3)Br)OC2=O

Isomeric SMILES

C1=CC=C(C=C1)CNCC2=CC3=C(C=CC(=C3)Br)OC2=O

InChI

InChI=1S/C17H14BrNO2/c18-15-6-7-16-13(9-15)8-14(17(20)21-16)11-19-10-12-4-2-1-3-5-12/h1-9,19H,10-11H2