2-(3-azanyl-4-oxidanylidene-3,8-dihydro-2H-1,5-benzoxazepin-8-id-5-yl)ethanoic acid; yttrium(3+)

Systemtic Name: 2-(3-azanyl-4-oxidanylidene-3,8-dihydro-2H-1,5-benzoxazepin-8-id-5-yl)ethanoic acid; yttrium(3+) Openeye Name: 2-(3-amino-4-oxo-3,8-dihydro-2H-1,5-benzoxazepin-8-id-5-yl)acetic acid; yttrium(3+) CAS Name: 2-(3-amino-4-oxo-3,8-dihydro-2H-1,5-benzoxazepin-8-id-5-yl)acetic acid; yttrium(3+) IUPAC Name: 2-(3-amino-4-oxo-3,8-dihydro-2H-1,5-benzoxazepin-8-id-5-yl)acetic acid; yttrium(3+) Traditional Name: 2-(3-amino-4-keto-3,8-dihydro-2H-1,5-benzoxazepin-8-id-5-yl)acetic acid; yttrium(3+) Formula: C11H11N2O4Y+2 MolecularWeight: 324.12189

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N(C2=CC=[C-]C=C2O1)CC(=O)O)N.[Y+3]

Isomeric SMILES

C1C(C(=O)N(C2=CC=[C-]C=C2O1)CC(=O)O)N.[Y+3]

InChI

InChI=1S/C11H11N2O4.Y/c12-7-6-17-9-4-2-1-3-8(9)13(11(7)16)5-10(14)15;/h1,3-4,7H,5-6,12H2,(H,14,15);/q-1;+3