2-(3-methyl-4-propan-2-yl-phenoxy)ethyl 4-oxidanylidene-3-propyl-phthalazine-1-carboxylate

Systemtic Name: 2-(3-methyl-4-propan-2-yl-phenoxy)ethyl 4-oxidanylidene-3-propyl-phthalazine-1-carboxylate Openeye Name: 2-(4-isopropyl-3-methyl-phenoxy)ethyl 4-oxo-3-propyl-phthalazine-1-carboxylate CAS Name: 4-oxo-3-propyl-1-phthalazinecarboxylic acid 2-(3-methyl-4-propan-2-ylphenoxy)ethyl ester IUPAC Name: 2-(3-methyl-4-propan-2-ylphenoxy)ethyl 4-oxo-3-propylphthalazine-1-carboxylate Traditional Name: 4-keto-3-propyl-phthalazine-1-carboxylic acid 2-(4-isopropyl-3-methyl-phenoxy)ethyl ester Formula: C24H28N2O4 MolecularWeight: 408.49012

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCCOC3=CC(=C(C=C3)C(C)C)C

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCCOC3=CC(=C(C=C3)C(C)C)C

InChI

InChI=1S/C24H28N2O4/c1-5-12-26-23(27)21-9-7-6-8-20(21)22(25-26)24(28)30-14-13-29-18-10-11-19(16(2)3)17(4)15-18/h6-11,15-16H,5,12-14H2,1-4H3