8-oxidanylidene-9-azabicyclo[10.4.0]hexadeca-1(16),12,14-triene-7,10-dicarboxylic acid

Systemtic Name: 8-oxidanylidene-9-azabicyclo[10.4.0]hexadeca-1(16),12,14-triene-7,10-dicarboxylic acid Openeye Name: 8-oxo-9-azabicyclo[10.4.0]hexadeca-1(16),12,14-triene-7,10-dicarboxylic acid CAS Name: 8-oxo-9-azabicyclo[10.4.0]hexadeca-1(16),12,14-triene-7,10-dicarboxylic acid IUPAC Name: 8-oxo-9-azabicyclo[10.4.0]hexadeca-1(16),12,14-triene-7,10-dicarboxylic acid Traditional Name: 8-keto-9-azabicyclo[10.4.0]hexadeca-1(16),12,14-triene-7,10-dicarboxylic acid Formula: C17H21NO5 MolecularWeight: 319.35234

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(=O)NC(CC2=CC=CC=C2CC1)C(=O)O)C(=O)O

Isomeric SMILES

C1CCC(C(=O)NC(CC2=CC=CC=C2CC1)C(=O)O)C(=O)O

InChI

InChI=1S/C17H21NO5/c19-15-13(16(20)21)9-3-1-2-6-11-7-4-5-8-12(11)10-14(18-15)17(22)23/h4-5,7-8,13-14H,1-3,6,9-10H2,(H,18,19)(H,20,21)(H,22,23)