4-[[(5-bromanylthiophen-2-yl)methyl-methyl-amino]methyl]-7-methoxy-chromen-2-one

Systemtic Name: 4-[[(5-bromanylthiophen-2-yl)methyl-methyl-amino]methyl]-7-methoxy-chromen-2-one Openeye Name: 4-[[(5-bromo-2-thienyl)methyl-methyl-amino]methyl]-7-methoxy-chromen-2-one CAS Name: 4-[[(5-bromo-2-thiophenyl)methyl-methylamino]methyl]-7-methoxy-1-benzopyran-2-one IUPAC Name: 4-[[(5-bromothiophen-2-yl)methyl-methylamino]methyl]-7-methoxychromen-2-one Traditional Name: 4-[[(5-bromo-2-thienyl)methyl-methyl-amino]methyl]-7-methoxy-coumarin Formula: C17H16BrNO3S MolecularWeight: 394.28284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16BrNO3S/c1-19(10-13-4-6-16(18)23-13)9-11-7-17(20)22-15-8-12(21-2)3-5-14(11)15/h3-8H,9-10H2,1-2H3