4-[[[(1S)-1-(4-ethylphenyl)-2-methyl-propyl]amino]methyl]-8-methyl-7-oxidanyl-chromen-2-one

Systemtic Name: 4-[[[(1S)-1-(4-ethylphenyl)-2-methyl-propyl]amino]methyl]-8-methyl-7-oxidanyl-chromen-2-one Openeye Name: 4-[[[(1S)-1-(4-ethylphenyl)-2-methyl-propyl]amino]methyl]-7-hydroxy-8-methyl-chromen-2-one CAS Name: 4-[[[(1S)-1-(4-ethylphenyl)-2-methylpropyl]amino]methyl]-7-hydroxy-8-methyl-1-benzopyran-2-one IUPAC Name: 4-[[[(1S)-1-(4-ethylphenyl)-2-methylpropyl]amino]methyl]-7-hydroxy-8-methylchromen-2-one Traditional Name: 4-[[[(1S)-1-(4-ethylphenyl)-2-methyl-propyl]amino]methyl]-7-hydroxy-8-methyl-coumarin Formula: C23H27NO3 MolecularWeight: 365.46538

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C(C)C)NCC2=CC(=O)OC3=C2C=CC(=C3C)O

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H](C(C)C)NCC2=CC(=O)OC3=C2C=CC(=C3C)O

InChI

InChI=1S/C23H27NO3/c1-5-16-6-8-17(9-7-16)22(14(2)3)24-13-18-12-21(26)27-23-15(4)20(25)11-10-19(18)23/h6-12,14,22,24-25H,5,13H2,1-4H3/t22-/m0/s1