(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 3-(furan-2-ylcarbonylamino)-4-methyl-benzoate

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 3-(furan-2-ylcarbonylamino)-4-methyl-benzoate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 3-(furan-2-carbonylamino)-4-methyl-benzoate CAS Name: 3-[[2-furanyl(oxo)methyl]amino]-4-methylbenzoic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 3-(furan-2-carbonylamino)-4-methylbenzoate Traditional Name: 3-(2-furoylamino)-4-methyl-benzoic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C21H16N4O5 MolecularWeight: 404.37554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCN2C(=O)C3=CC=CC=C3N=N2)NC(=O)C4=CC=CO4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCN2C(=O)C3=CC=CC=C3N=N2)NC(=O)C4=CC=CO4

InChI

InChI=1S/C21H16N4O5/c1-13-8-9-14(11-17(13)22-19(26)18-7-4-10-29-18)21(28)30-12-25-20(27)15-5-2-3-6-16(15)23-24-25/h2-11H,12H2,1H3,(H,22,26)