5-ethyl-1-methyl-3,7-bis[(4-methylphenyl)carbonyl]-3,7-diazabicyclo[3.3.1]nonan-9-one

Systemtic Name: 5-ethyl-1-methyl-3,7-bis[(4-methylphenyl)carbonyl]-3,7-diazabicyclo[3.3.1]nonan-9-one Openeye Name: 5-ethyl-1-methyl-3,7-bis(4-methylbenzoyl)-3,7-diazabicyclo[3.3.1]nonan-9-one CAS Name: 5-ethyl-1-methyl-3,7-bis[(4-methylphenyl)-oxomethyl]-3,7-diazabicyclo[3.3.1]nonan-9-one IUPAC Name: 5-ethyl-1-methyl-3,7-bis(4-methylbenzoyl)-3,7-diazabicyclo[3.3.1]nonan-9-one Traditional Name: 5-ethyl-1-methyl-3,7-bis(p-toluoyl)-3,7-diazabicyclo[3.3.1]nonan-9-one Formula: C26H30N2O3 MolecularWeight: 418.528

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Descriptors Computed from Structure

Canonical SMILES:

CCC12CN(CC(C1=O)(CN(C2)C(=O)C3=CC=C(C=C3)C)C)C(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCC12CN(CC(C1=O)(CN(C2)C(=O)C3=CC=C(C=C3)C)C)C(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C26H30N2O3/c1-5-26-16-27(22(29)20-10-6-18(2)7-11-20)14-25(4,24(26)31)15-28(17-26)23(30)21-12-8-19(3)9-13-21/h6-13H,5,14-17H2,1-4H3