4-(6H-benzo[b][1,4]benzoxazepin-5-ylmethyl)thiophene-2-carboxylic acid

Systemtic Name: 4-(6H-benzo[b][1,4]benzoxazepin-5-ylmethyl)thiophene-2-carboxylic acid Openeye Name: 4-(6H-benzo[b][1,4]benzoxazepin-5-ylmethyl)thiophene-2-carboxylic acid CAS Name: 4-(6H-benzo[b][1,4]benzoxazepin-5-ylmethyl)-2-thiophenecarboxylic acid IUPAC Name: 4-(6H-benzo[b][1,4]benzoxazepin-5-ylmethyl)thiophene-2-carboxylic acid Traditional Name: 4-(6H-benzo[b][1,4]benzoxazepin-5-ylmethyl)-2-thenoic acid Formula: C19H15NO3S MolecularWeight: 337.3923

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2OC3=CC=CC=C3N1CC4=CSC(=C4)C(=O)O

Isomeric SMILES

C1C2=CC=CC=C2OC3=CC=CC=C3N1CC4=CSC(=C4)C(=O)O

InChI

InChI=1S/C19H15NO3S/c21-19(22)18-9-13(12-24-18)10-20-11-14-5-1-3-7-16(14)23-17-8-4-2-6-15(17)20/h1-9,12H,10-11H2,(H,21,22)