3-[3-(tert-butylamino)-2-oxidanyl-propoxy]-5-methyl-chromen-2-one

Systemtic Name: 3-[3-(tert-butylamino)-2-oxidanyl-propoxy]-5-methyl-chromen-2-one Openeye Name: 3-[3-(tert-butylamino)-2-hydroxy-propoxy]-5-methyl-chromen-2-one CAS Name: 3-[3-(tert-butylamino)-2-hydroxypropoxy]-5-methyl-1-benzopyran-2-one IUPAC Name: 3-[3-(tert-butylamino)-2-hydroxypropoxy]-5-methylchromen-2-one Traditional Name: 3-[3-(tert-butylamino)-2-hydroxy-propoxy]-5-methyl-coumarin Formula: C17H23NO4 MolecularWeight: 305.36882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C(=O)OC2=CC=C1)OCC(CNC(C)(C)C)O

Isomeric SMILES

CC1=C2C=C(C(=O)OC2=CC=C1)OCC(CNC(C)(C)C)O

InChI

InChI=1S/C17H23NO4/c1-11-6-5-7-14-13(11)8-15(16(20)22-14)21-10-12(19)9-18-17(2,3)4/h5-8,12,18-19H,9-10H2,1-4H3