3-tert-butyl-6-[2-(1-methylpiperidin-2-yl)ethoxy]chromen-2-one

Systemtic Name: 3-tert-butyl-6-[2-(1-methylpiperidin-2-yl)ethoxy]chromen-2-one Openeye Name: 3-tert-butyl-6-[2-(1-methyl-2-piperidyl)ethoxy]chromen-2-one CAS Name: 3-tert-butyl-6-[2-(1-methyl-2-piperidinyl)ethoxy]-1-benzopyran-2-one IUPAC Name: 3-tert-butyl-6-[2-(1-methylpiperidin-2-yl)ethoxy]chromen-2-one Traditional Name: 3-tert-butyl-6-[2-(1-methyl-2-piperidyl)ethoxy]coumarin Formula: C21H29NO3 MolecularWeight: 343.45986

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=CC(=C2)OCCC3CCCCN3C)OC1=O

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=CC(=C2)OCCC3CCCCN3C)OC1=O

InChI

InChI=1S/C21H29NO3/c1-21(2,3)18-14-15-13-17(8-9-19(15)25-20(18)23)24-12-10-16-7-5-6-11-22(16)4/h8-9,13-14,16H,5-7,10-12H2,1-4H3