4-(8-methyl-5-oxidanylidene-pyrido[2,3-b][1,5]benzoxazepin-6-yl)butanoic acid

Systemtic Name: 4-(8-methyl-5-oxidanylidene-pyrido[2,3-b][1,5]benzoxazepin-6-yl)butanoic acid Openeye Name: 4-(8-methyl-5-oxo-pyrido[2,3-b][1,5]benzoxazepin-6-yl)butanoic acid CAS Name: 4-(8-methyl-5-oxo-6-pyrido[2,3-b][1,5]benzoxazepinyl)butanoic acid IUPAC Name: 4-(8-methyl-5-oxopyrido[2,3-b][1,5]benzoxazepin-6-yl)butanoic acid Traditional Name: 4-(5-keto-8-methyl-pyrido[2,3-b][1,5]benzoxazepin-6-yl)butyric acid Formula: C17H16N2O4 MolecularWeight: 312.31994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC3=C(C=CC=N3)C(=O)N2CCCC(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)OC3=C(C=CC=N3)C(=O)N2CCCC(=O)O

InChI

InChI=1S/C17H16N2O4/c1-11-6-7-14-13(10-11)19(9-3-5-15(20)21)17(22)12-4-2-8-18-16(12)23-14/h2,4,6-8,10H,3,5,9H2,1H3,(H,20,21)