1H-1-benzazepin-6-yl 5-methoxy-7-oxidanylidene-bicyclo[4.1.0]hepta-1(6),2,4-triene-4-carboxylate

Systemtic Name: 1H-1-benzazepin-6-yl 5-methoxy-7-oxidanylidene-bicyclo[4.1.0]hepta-1(6),2,4-triene-4-carboxylate Openeye Name: 1H-1-benzazepin-6-yl 5-methoxy-7-oxo-bicyclo[4.1.0]hepta-1(6),2,4-triene-4-carboxylate CAS Name: 5-methoxy-7-oxo-4-bicyclo[4.1.0]hepta-1(6),2,4-trienecarboxylic acid 1H-1-benzazepin-6-yl ester IUPAC Name: 1H-1-benzazepin-6-yl 5-methoxy-7-oxobicyclo[4.1.0]hepta-1(6),2,4-triene-4-carboxylate Traditional Name: 7-keto-5-methoxy-bicyclo[4.1.0]hepta-1(6),2,4-triene-4-carboxylic acid 1H-1-benzazepin-6-yl ester Formula: C19H13NO4 MolecularWeight: 319.31082

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC2=C1C2=O)C(=O)OC3=CC=CC4=C3C=CC=CN4

Isomeric SMILES

COC1=C(C=CC2=C1C2=O)C(=O)OC3=CC=CC4=C3C=CC=CN4

InChI

InChI=1S/C19H13NO4/c1-23-18-13(9-8-12-16(18)17(12)21)19(22)24-15-7-4-6-14-11(15)5-2-3-10-20-14/h2-10,20H,1H3