6-tert-butyl-4-[(4-phenylpiperazin-1-yl)methyl]chromen-2-one

Systemtic Name: 6-tert-butyl-4-[(4-phenylpiperazin-1-yl)methyl]chromen-2-one Openeye Name: 6-tert-butyl-4-[(4-phenylpiperazin-1-yl)methyl]chromen-2-one CAS Name: 6-tert-butyl-4-[(4-phenyl-1-piperazinyl)methyl]-1-benzopyran-2-one IUPAC Name: 6-tert-butyl-4-[(4-phenylpiperazin-1-yl)methyl]chromen-2-one Traditional Name: 6-tert-butyl-4-[(4-phenylpiperazino)methyl]coumarin Formula: C24H28N2O2 MolecularWeight: 376.49132

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)OC(=O)C=C2CN3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)OC(=O)C=C2CN3CCN(CC3)C4=CC=CC=C4

InChI

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