3,7-di(butanoyl)-1,5-diphenyl-3,7-diazabicyclo[3.3.1]nonan-9-one

Systemtic Name: 3,7-di(butanoyl)-1,5-diphenyl-3,7-diazabicyclo[3.3.1]nonan-9-one Openeye Name: 3,7-di(butanoyl)-1,5-diphenyl-3,7-diazabicyclo[3.3.1]nonan-9-one CAS Name: 3,7-bis(1-oxobutyl)-1,5-diphenyl-3,7-diazabicyclo[3.3.1]nonan-9-one IUPAC Name: 3,7-di(butanoyl)-1,5-diphenyl-3,7-diazabicyclo[3.3.1]nonan-9-one Traditional Name: 3,7-dibutyryl-1,5-diphenyl-3,7-diazabicyclo[3.3.1]nonan-9-one Formula: C27H32N2O3 MolecularWeight: 432.55458

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CC2(CN(CC(C1)(C2=O)C3=CC=CC=C3)C(=O)CCC)C4=CC=CC=C4

Isomeric SMILES

CCCC(=O)N1CC2(CN(CC(C1)(C2=O)C3=CC=CC=C3)C(=O)CCC)C4=CC=CC=C4

InChI

InChI=1S/C27H32N2O3/c1-3-11-23(30)28-17-26(21-13-7-5-8-14-21)19-29(24(31)12-4-2)20-27(18-28,25(26)32)22-15-9-6-10-16-22/h5-10,13-16H,3-4,11-12,17-20H2,1-2H3