7-[[4-(4-tert-butylphenyl)piperazin-1-yl]methyl]chromen-2-one

Systemtic Name: 7-[[4-(4-tert-butylphenyl)piperazin-1-yl]methyl]chromen-2-one Openeye Name: 7-[[4-(4-tert-butylphenyl)piperazin-1-yl]methyl]chromen-2-one CAS Name: 7-[[4-(4-tert-butylphenyl)-1-piperazinyl]methyl]-1-benzopyran-2-one IUPAC Name: 7-[[4-(4-tert-butylphenyl)piperazin-1-yl]methyl]chromen-2-one Traditional Name: 7-[[4-(4-tert-butylphenyl)piperazino]methyl]coumarin Formula: C24H28N2O2 MolecularWeight: 376.49132

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)N2CCN(CC2)CC3=CC4=C(C=C3)C=CC(=O)O4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)N2CCN(CC2)CC3=CC4=C(C=C3)C=CC(=O)O4

InChI

InChI=1S/C24H28N2O2/c1-24(2,3)20-7-9-21(10-8-20)26-14-12-25(13-15-26)17-18-4-5-19-6-11-23(27)28-22(19)16-18/h4-11,16H,12-15,17H2,1-3H3