4-(6-oxidanylidene-5H-benzo[b][1,4]benzoxazepin-10-yl)piperazine-1-carboxylic acid

Systemtic Name: 4-(6-oxidanylidene-5H-benzo[b][1,4]benzoxazepin-10-yl)piperazine-1-carboxylic acid Openeye Name: 4-(6-oxo-5H-benzo[b][1,4]benzoxazepin-10-yl)piperazine-1-carboxylic acid CAS Name: 4-(6-oxo-5H-benzo[b][1,4]benzoxazepin-10-yl)-1-piperazinecarboxylic acid IUPAC Name: 4-(6-oxo-5H-benzo[b][1,4]benzoxazepin-10-yl)piperazine-1-carboxylic acid Traditional Name: 4-(6-keto-5H-benzo[b][1,4]benzoxazepin-10-yl)piperazine-1-carboxylic acid Formula: C18H17N3O4 MolecularWeight: 339.34528

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC3=C2OC4=CC=CC=C4NC3=O)C(=O)O

Isomeric SMILES

C1CN(CCN1C2=CC=CC3=C2OC4=CC=CC=C4NC3=O)C(=O)O

InChI

InChI=1S/C18H17N3O4/c22-17-12-4-3-6-14(20-8-10-21(11-9-20)18(23)24)16(12)25-15-7-2-1-5-13(15)19-17/h1-7H,8-11H2,(H,19,22)(H,23,24)