(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 4-pentoxybenzoate

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 4-pentoxybenzoate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 4-pentoxybenzoate CAS Name: 4-pentoxybenzoic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 4-pentoxybenzoate Traditional Name: 4-amoxybenzoic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C20H21N3O4 MolecularWeight: 367.39844

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)OCN2C(=O)C3=CC=CC=C3N=N2

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)OCN2C(=O)C3=CC=CC=C3N=N2

InChI

InChI=1S/C20H21N3O4/c1-2-3-6-13-26-16-11-9-15(10-12-16)20(25)27-14-23-19(24)17-7-4-5-8-18(17)21-22-23/h4-5,7-12H,2-3,6,13-14H2,1H3