6-[4-(4-chloranylphenoxy)but-2-ynyl-methyl-amino]chromen-2-one

Systemtic Name: 6-[4-(4-chloranylphenoxy)but-2-ynyl-methyl-amino]chromen-2-one Openeye Name: 6-[4-(4-chlorophenoxy)but-2-ynyl-methyl-amino]chromen-2-one CAS Name: 6-[4-(4-chlorophenoxy)but-2-ynyl-methylamino]-1-benzopyran-2-one IUPAC Name: 6-[4-(4-chlorophenoxy)but-2-ynyl-methylamino]chromen-2-one Traditional Name: 6-[4-(4-chlorophenoxy)but-2-ynyl-methyl-amino]coumarin Formula: C20H16ClNO3 MolecularWeight: 353.79894

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC#CCOC1=CC=C(C=C1)Cl)C2=CC3=C(C=C2)OC(=O)C=C3

Isomeric SMILES

CN(CC#CCOC1=CC=C(C=C1)Cl)C2=CC3=C(C=C2)OC(=O)C=C3

InChI

InChI=1S/C20H16ClNO3/c1-22(12-2-3-13-24-18-8-5-16(21)6-9-18)17-7-10-19-15(14-17)4-11-20(23)25-19/h4-11,14H,12-13H2,1H3