4,6-bis(oxidanylidene)-13-propyl-11H-chromeno[7,6-c][2]benzoxepine-2-carboxylic acid

Systemtic Name: 4,6-bis(oxidanylidene)-13-propyl-11H-chromeno[7,6-c][2]benzoxepine-2-carboxylic acid Openeye Name: 4,6-dioxo-13-propyl-11H-chromeno[7,6-c][2]benzoxepine-2-carboxylic acid CAS Name: 4,6-dioxo-13-propyl-11H-[1]benzopyrano[7,6-c][2]benzoxepin-2-carboxylic acid IUPAC Name: 4,6-dioxo-13-propyl-11H-chromeno[7,6-c][2]benzoxepine-2-carboxylic acid Traditional Name: 4,6-diketo-13-propyl-11H-chromeno[7,6-c][2]benzoxepin-2-carboxylic acid Formula: C21H16O6 MolecularWeight: 364.34814

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2C(=CC3=C1OCC4=CC=CC=C4C3=O)C(=O)C=C(O2)C(=O)O

Isomeric SMILES

CCCC1=C2C(=CC3=C1OCC4=CC=CC=C4C3=O)C(=O)C=C(O2)C(=O)O

InChI

InChI=1S/C21H16O6/c1-2-5-13-19-15(18(23)12-7-4-3-6-11(12)10-26-19)8-14-16(22)9-17(21(24)25)27-20(13)14/h3-4,6-9H,2,5,10H2,1H3,(H,24,25)