ethyl 3-(6H-pyrido[2,3-b][1,4]benzoxazepin-5-ylcarbonylamino)benzoate

Systemtic Name: ethyl 3-(6H-pyrido[2,3-b][1,4]benzoxazepin-5-ylcarbonylamino)benzoate Openeye Name: ethyl 3-(6H-pyrido[2,3-b][1,4]benzoxazepine-5-carbonylamino)benzoate CAS Name: 3-[[oxo(6H-pyrido[2,3-b][1,4]benzoxazepin-5-yl)methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-(6H-pyrido[2,3-b][1,4]benzoxazepine-5-carbonylamino)benzoate Traditional Name: 3-(6H-pyrido[2,3-b][1,4]benzoxazepine-5-carbonylamino)benzoic acid ethyl ester Formula: C22H19N3O4 MolecularWeight: 389.40396

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)N2CC3=CC=CC=C3OC4=C2C=CC=N4

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)N2CC3=CC=CC=C3OC4=C2C=CC=N4

InChI

InChI=1S/C22H19N3O4/c1-2-28-21(26)15-8-5-9-17(13-15)24-22(27)25-14-16-7-3-4-11-19(16)29-20-18(25)10-6-12-23-20/h3-13H,2,14H2,1H3,(H,24,27)