(5-azanylidene-3-methyl-1,2-oxazol-4-ylidene)-[(2R)-1-(1,3-benzodioxol-5-ylamino)-1-oxidanylidene-propan-2-yl]oxy-methanolate

Systemtic Name: (5-azanylidene-3-methyl-1,2-oxazol-4-ylidene)-[(2R)-1-(1,3-benzodioxol-5-ylamino)-1-oxidanylidene-propan-2-yl]oxy-methanolate Openeye Name: [(1R)-2-(1,3-benzodioxol-5-ylamino)-1-methyl-2-oxo-ethoxy]-(5-imino-3-methyl-isoxazol-4-ylidene)methanolate CAS Name: [(2R)-1-(1,3-benzodioxol-5-ylamino)-1-oxopropan-2-yl]oxy-(5-imino-3-methyl-4-isoxazolylidene)methanolate IUPAC Name: [(2R)-1-(1,3-benzodioxol-5-ylamino)-1-oxopropan-2-yl]oxy-(5-imino-3-methyl-1,2-oxazol-4-ylidene)methanolate Traditional Name: [(1R)-2-(1,3-benzodioxol-5-ylamino)-2-keto-1-methyl-ethoxy]-(5-imino-3-methyl-2-isoxazolin-4-ylidene)methanolate Formula: C15H14N3O6- MolecularWeight: 332.28816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=N)C1=C([O-])OC(C)C(=O)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=NOC(=N)C1=C([O-])O[C@H](C)C(=O)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C15H15N3O6/c1-7-12(13(16)24-18-7)15(20)23-8(2)14(19)17-9-3-4-10-11(5-9)22-6-21-10/h3-5,8,16,20H,6H2,1-2H3,(H,17,19)/p-1/t8-/m1/s1