4-methyl-7-(4-pyrrolidin-1-ylbut-2-ynoxy)chromen-2-one

Systemtic Name: 4-methyl-7-(4-pyrrolidin-1-ylbut-2-ynoxy)chromen-2-one Openeye Name: 4-methyl-7-(4-pyrrolidin-1-ylbut-2-ynoxy)chromen-2-one CAS Name: 4-methyl-7-[4-(1-pyrrolidinyl)but-2-ynoxy]-1-benzopyran-2-one IUPAC Name: 4-methyl-7-(4-pyrrolidin-1-ylbut-2-ynoxy)chromen-2-one Traditional Name: 4-methyl-7-(4-pyrrolidinobut-2-ynoxy)coumarin Formula: C18H19NO3 MolecularWeight: 297.34836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OCC#CCN3CCCC3

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)OCC#CCN3CCCC3

InChI

InChI=1S/C18H19NO3/c1-14-12-18(20)22-17-13-15(6-7-16(14)17)21-11-5-4-10-19-8-2-3-9-19/h6-7,12-13H,2-3,8-11H2,1H3