6-naphthalen-2-ylcarbonyl-5-oxidanyl-2-(4-phenylbutanoyl)-2,3,6-triazabicyclo[3.3.1]nonan-4-one

Systemtic Name: 6-naphthalen-2-ylcarbonyl-5-oxidanyl-2-(4-phenylbutanoyl)-2,3,6-triazabicyclo[3.3.1]nonan-4-one Openeye Name: 5-hydroxy-6-(naphthalene-2-carbonyl)-2-(4-phenylbutanoyl)-2,3,6-triazabicyclo[3.3.1]nonan-4-one CAS Name: 5-hydroxy-6-[2-naphthalenyl(oxo)methyl]-2-(1-oxo-4-phenylbutyl)-2,3,6-triazabicyclo[3.3.1]nonan-4-one IUPAC Name: 5-hydroxy-6-(naphthalene-2-carbonyl)-2-(4-phenylbutanoyl)-2,3,6-triazabicyclo[3.3.1]nonan-4-one Traditional Name: 5-hydroxy-6-(2-naphthoyl)-2-(4-phenylbutanoyl)-2,3,6-triazabicyclo[3.3.1]nonan-4-one Formula: C27H27N3O4 MolecularWeight: 457.52098

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2(CC1N(NC2=O)C(=O)CCCC3=CC=CC=C3)O)C(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CN(C2(CC1N(NC2=O)C(=O)CCCC3=CC=CC=C3)O)C(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C27H27N3O4/c31-24(12-6-9-19-7-2-1-3-8-19)30-23-15-16-29(27(34,18-23)26(33)28-30)25(32)22-14-13-20-10-4-5-11-21(20)17-22/h1-5,7-8,10-11,13-14,17,23,34H,6,9,12,15-16,18H2,(H,28,33)