(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 3-methoxy-4-(2-methylpropoxy)benzoate

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 3-methoxy-4-(2-methylpropoxy)benzoate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 4-isobutoxy-3-methoxy-benzoate CAS Name: 3-methoxy-4-(2-methylpropoxy)benzoic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 3-methoxy-4-(2-methylpropoxy)benzoate Traditional Name: 4-isobutoxy-3-methoxy-benzoic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C20H21N3O5 MolecularWeight: 383.39784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)C(=O)OCN2C(=O)C3=CC=CC=C3N=N2)OC

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)C(=O)OCN2C(=O)C3=CC=CC=C3N=N2)OC

InChI

InChI=1S/C20H21N3O5/c1-13(2)11-27-17-9-8-14(10-18(17)26-3)20(25)28-12-23-19(24)15-6-4-5-7-16(15)21-22-23/h4-10,13H,11-12H2,1-3H3