ethyl 2-[4-oxidanylidene-3-(3-phenylpropyl)phthalazin-1-yl]ethanoate

Systemtic Name: ethyl 2-[4-oxidanylidene-3-(3-phenylpropyl)phthalazin-1-yl]ethanoate Openeye Name: ethyl 2-[4-oxo-3-(3-phenylpropyl)phthalazin-1-yl]acetate CAS Name: 2-[4-oxo-3-(3-phenylpropyl)-1-phthalazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-oxo-3-(3-phenylpropyl)phthalazin-1-yl]acetate Traditional Name: 2-[4-keto-3-(3-phenylpropyl)phthalazin-1-yl]acetic acid ethyl ester Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=NN(C(=O)C2=CC=CC=C21)CCCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CC1=NN(C(=O)C2=CC=CC=C21)CCCC3=CC=CC=C3

InChI

InChI=1S/C21H22N2O3/c1-2-26-20(24)15-19-17-12-6-7-13-18(17)21(25)23(22-19)14-8-11-16-9-4-3-5-10-16/h3-7,9-10,12-13H,2,8,11,14-15H2,1H3