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

Systemtic Name: 1-methyl-3,7-bis[(4-nitrophenyl)carbonyl]-5-propyl-3,7-diazabicyclo[3.3.1]nonan-9-one Openeye Name: 1-methyl-3,7-bis(4-nitrobenzoyl)-5-propyl-3,7-diazabicyclo[3.3.1]nonan-9-one CAS Name: 1-methyl-3,7-bis[(4-nitrophenyl)-oxomethyl]-5-propyl-3,7-diazabicyclo[3.3.1]nonan-9-one IUPAC Name: 1-methyl-3,7-bis(4-nitrobenzoyl)-5-propyl-3,7-diazabicyclo[3.3.1]nonan-9-one Traditional Name: 1-methyl-3,7-bis(4-nitrobenzoyl)-5-propyl-3,7-diazabicyclo[3.3.1]nonan-9-one Formula: C25H26N4O7 MolecularWeight: 494.49654

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Descriptors Computed from Structure

Canonical SMILES:

CCCC12CN(CC(C1=O)(CN(C2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-])C)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCCC12CN(CC(C1=O)(CN(C2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-])C)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H26N4O7/c1-3-12-25-15-26(21(30)17-4-8-19(9-5-17)28(33)34)13-24(2,23(25)32)14-27(16-25)22(31)18-6-10-20(11-7-18)29(35)36/h4-11H,3,12-16H2,1-2H3