methyl 2-[3-[(4-oxidanylidene-3-propan-2-yl-phthalazin-1-yl)carbonylamino]phenoxy]ethanoate

Systemtic Name: methyl 2-[3-[(4-oxidanylidene-3-propan-2-yl-phthalazin-1-yl)carbonylamino]phenoxy]ethanoate Openeye Name: methyl 2-[3-[(3-isopropyl-4-oxo-phthalazine-1-carbonyl)amino]phenoxy]acetate CAS Name: 2-[3-[[oxo-(4-oxo-3-propan-2-yl-1-phthalazinyl)methyl]amino]phenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[3-[(4-oxo-3-propan-2-ylphthalazine-1-carbonyl)amino]phenoxy]acetate Traditional Name: 2-[3-[(3-isopropyl-4-keto-phthalazine-1-carbonyl)amino]phenoxy]acetic acid methyl ester Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC(=CC=C3)OCC(=O)OC

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC(=CC=C3)OCC(=O)OC

InChI

InChI=1S/C21H21N3O5/c1-13(2)24-21(27)17-10-5-4-9-16(17)19(23-24)20(26)22-14-7-6-8-15(11-14)29-12-18(25)28-3/h4-11,13H,12H2,1-3H3,(H,22,26)