[(E)-3-cyano-4-oxidanylidene-4-(3-oxidanylidene-4-prop-2-enyl-1,4-benzoxazin-6-yl)but-2-en-2-yl]azanide; yttrium(3+)

Systemtic Name: [(E)-3-cyano-4-oxidanylidene-4-(3-oxidanylidene-4-prop-2-enyl-1,4-benzoxazin-6-yl)but-2-en-2-yl]azanide; yttrium(3+) Openeye Name: [(E)-3-(4-allyl-3-oxo-1,4-benzoxazin-6-yl)-2-cyano-1-methyl-3-oxo-prop-1-enyl]azanide; yttrium(3+) CAS Name: [(E)-3-cyano-4-oxo-4-(3-oxo-4-prop-2-enyl-1,4-benzoxazin-6-yl)but-2-en-2-yl]azanide; yttrium(3+) IUPAC Name: [(E)-3-cyano-4-oxo-4-(3-oxo-4-prop-2-enyl-1,4-benzoxazin-6-yl)but-2-en-2-yl]azanide; yttrium(3+) Traditional Name: [(E)-3-(4-allyl-3-keto-1,4-benzoxazin-6-yl)-2-cyano-3-keto-1-methyl-prop-1-enyl]azanide; yttrium(3+) Formula: C16H14N3O3Y+2 MolecularWeight: 385.20651

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C#N)C(=O)C1=CC2=C(C=C1)OCC(=O)N2CC=C)[NH-].[Y+3]

Isomeric SMILES

C/C(=C(/C#N)\C(=O)C1=CC2=C(C=C1)OCC(=O)N2CC=C)/[NH-].[Y+3]

InChI

InChI=1S/C16H15N3O3.Y/c1-3-6-19-13-7-11(16(21)12(8-17)10(2)18)4-5-14(13)22-9-15(19)20;/h3-5,7H,1,6,9H2,2H3,(H2,18,21);/q;+3/p-1