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

Systemtic Name: 7-methylidene-8-oxidanylidene-9-azabicyclo[10.4.0]hexadeca-1(16),12,14-triene-10-carboxylic acid Openeye Name: 7-methylene-8-oxo-9-azabicyclo[10.4.0]hexadeca-1(16),12,14-triene-10-carboxylic acid CAS Name: 7-methylene-8-oxo-9-azabicyclo[10.4.0]hexadeca-1(16),12,14-triene-10-carboxylic acid IUPAC Name: 7-methylidene-8-oxo-9-azabicyclo[10.4.0]hexadeca-1(16),12,14-triene-10-carboxylic acid Traditional Name: 8-keto-7-methylene-9-azabicyclo[10.4.0]hexadeca-1(16),12,14-triene-10-carboxylic acid Formula: C17H21NO3 MolecularWeight: 287.35354

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Descriptors Computed from Structure

Canonical SMILES:

C=C1CCCCCC2=CC=CC=C2CC(NC1=O)C(=O)O

Isomeric SMILES

C=C1CCCCCC2=CC=CC=C2CC(NC1=O)C(=O)O

InChI

InChI=1S/C17H21NO3/c1-12-7-3-2-4-8-13-9-5-6-10-14(13)11-15(17(20)21)18-16(12)19/h5-6,9-10,15H,1-4,7-8,11H2,(H,18,19)(H,20,21)