6-ethyl-4-[[methyl(thiophen-2-ylmethyl)amino]methyl]-7-oxidanyl-chromen-2-one

Systemtic Name: 6-ethyl-4-[[methyl(thiophen-2-ylmethyl)amino]methyl]-7-oxidanyl-chromen-2-one Openeye Name: 6-ethyl-7-hydroxy-4-[[methyl(2-thienylmethyl)amino]methyl]chromen-2-one CAS Name: 6-ethyl-7-hydroxy-4-[[methyl(thiophen-2-ylmethyl)amino]methyl]-1-benzopyran-2-one IUPAC Name: 6-ethyl-7-hydroxy-4-[[methyl(thiophen-2-ylmethyl)amino]methyl]chromen-2-one Traditional Name: 6-ethyl-7-hydroxy-4-[[methyl(2-thenyl)amino]methyl]coumarin Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CN(C)CC3=CC=CS3)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CN(C)CC3=CC=CS3)O

InChI

InChI=1S/C18H19NO3S/c1-3-12-7-15-13(8-18(21)22-17(15)9-16(12)20)10-19(2)11-14-5-4-6-23-14/h4-9,20H,3,10-11H2,1-2H3