8-methyl-7-oxidanyl-4-[[2-(4-propan-2-ylphenyl)ethylamino]methyl]chromen-2-one

Systemtic Name: 8-methyl-7-oxidanyl-4-[[2-(4-propan-2-ylphenyl)ethylamino]methyl]chromen-2-one Openeye Name: 7-hydroxy-4-[[2-(4-isopropylphenyl)ethylamino]methyl]-8-methyl-chromen-2-one CAS Name: 7-hydroxy-8-methyl-4-[[2-(4-propan-2-ylphenyl)ethylamino]methyl]-1-benzopyran-2-one IUPAC Name: 7-hydroxy-8-methyl-4-[[2-(4-propan-2-ylphenyl)ethylamino]methyl]chromen-2-one Traditional Name: 7-hydroxy-8-methyl-4-[(2-p-cumenylethylamino)methyl]coumarin Formula: C22H25NO3 MolecularWeight: 351.4388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2CNCCC3=CC=C(C=C3)C(C)C)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2CNCCC3=CC=C(C=C3)C(C)C)O

InChI

InChI=1S/C22H25NO3/c1-14(2)17-6-4-16(5-7-17)10-11-23-13-18-12-21(25)26-22-15(3)20(24)9-8-19(18)22/h4-9,12,14,23-24H,10-11,13H2,1-3H3