4-[[(5-chloranylthiophen-2-yl)methyl-methyl-amino]methyl]-7-oxidanyl-chromen-2-one

Systemtic Name: 4-[[(5-chloranylthiophen-2-yl)methyl-methyl-amino]methyl]-7-oxidanyl-chromen-2-one Openeye Name: 4-[[(5-chloro-2-thienyl)methyl-methyl-amino]methyl]-7-hydroxy-chromen-2-one CAS Name: 4-[[(5-chloro-2-thiophenyl)methyl-methylamino]methyl]-7-hydroxy-1-benzopyran-2-one IUPAC Name: 4-[[(5-chlorothiophen-2-yl)methyl-methylamino]methyl]-7-hydroxychromen-2-one Traditional Name: 4-[[(5-chloro-2-thienyl)methyl-methyl-amino]methyl]-7-hydroxy-coumarin Formula: C16H14ClNO3S MolecularWeight: 335.80526

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(S1)Cl)CC2=CC(=O)OC3=C2C=CC(=C3)O

Isomeric SMILES

CN(CC1=CC=C(S1)Cl)CC2=CC(=O)OC3=C2C=CC(=C3)O

InChI

InChI=1S/C16H14ClNO3S/c1-18(9-12-3-5-15(17)22-12)8-10-6-16(20)21-14-7-11(19)2-4-13(10)14/h2-7,19H,8-9H2,1H3