2-methyl-7-(2-methyloctan-2-yl)-4-(2-oxidanylpropylamino)-2,3-dihydrochromen-5-one

Systemtic Name: 2-methyl-7-(2-methyloctan-2-yl)-4-(2-oxidanylpropylamino)-2,3-dihydrochromen-5-one Openeye Name: 7-(1,1-dimethylheptyl)-4-(2-hydroxypropylamino)-2-methyl-2,3-dihydrochromen-5-one CAS Name: 4-(2-hydroxypropylamino)-2-methyl-7-(2-methyloctan-2-yl)-2,3-dihydro-1-benzopyran-5-one IUPAC Name: 4-(2-hydroxypropylamino)-2-methyl-7-(2-methyloctan-2-yl)-2,3-dihydrochromen-5-one Traditional Name: 7-(1,1-dimethylheptyl)-4-(2-hydroxypropylamino)-2-methyl-2,3-dihydrochromen-5-one Formula: C22H35NO3 MolecularWeight: 361.5182

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(C)C1=CC(=O)C2=C(CC(OC2=C1)C)NCC(C)O

Isomeric SMILES

CCCCCCC(C)(C)C1=CC(=O)C2=C(CC(OC2=C1)C)NCC(C)O

InChI

InChI=1S/C22H35NO3/c1-6-7-8-9-10-22(4,5)17-12-19(25)21-18(23-14-15(2)24)11-16(3)26-20(21)13-17/h12-13,15-16,23-24H,6-11,14H2,1-5H3