(Z)-3-azanyl-3-[5-azanyl-3-(4-methylphenyl)-1,2-oxazol-4-yl]-2-cyano-prop-2-enoic acid

Systemtic Name: (Z)-3-azanyl-3-[5-azanyl-3-(4-methylphenyl)-1,2-oxazol-4-yl]-2-cyano-prop-2-enoic acid Openeye Name: (Z)-3-amino-3-[5-amino-3-(p-tolyl)isoxazol-4-yl]-2-cyano-prop-2-enoic acid CAS Name: (Z)-3-amino-3-[5-amino-3-(4-methylphenyl)-4-isoxazolyl]-2-cyano-2-propenoic acid IUPAC Name: (Z)-3-amino-3-[5-amino-3-(4-methylphenyl)-1,2-oxazol-4-yl]-2-cyanoprop-2-enoic acid Traditional Name: (Z)-3-amino-3-[5-amino-3-(p-tolyl)isoxazol-4-yl]-2-cyano-acrylic acid Formula: C14H12N4O3 MolecularWeight: 284.27008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NOC(=C2C(=C(C#N)C(=O)O)N)N

Isomeric SMILES

CC1=CC=C(C=C1)C2=NOC(=C2/C(=C(\C#N)/C(=O)O)/N)N

InChI

InChI=1S/C14H12N4O3/c1-7-2-4-8(5-3-7)12-10(13(17)21-18-12)11(16)9(6-15)14(19)20/h2-5H,16-17H2,1H3,(H,19,20)/b11-9-