2-(phenylcarbonyloxy)ethyl 3-butyl-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: 2-(phenylcarbonyloxy)ethyl 3-butyl-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: 2-benzoyloxyethyl 3-butyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-butyl-4-oxo-1-phthalazinecarboxylic acid 2-benzoyloxyethyl ester IUPAC Name: 2-benzoyloxyethyl 3-butyl-4-oxophthalazine-1-carboxylate Traditional Name: 3-butyl-4-keto-phthalazine-1-carboxylic acid 2-benzoyloxyethyl ester Formula: C22H22N2O5 MolecularWeight: 394.42048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCCOC(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCCOC(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H22N2O5/c1-2-3-13-24-20(25)18-12-8-7-11-17(18)19(23-24)22(27)29-15-14-28-21(26)16-9-5-4-6-10-16/h4-12H,2-3,13-15H2,1H3