methyl 2-[3-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazin-1-yl]ethanoate

Systemtic Name: methyl 2-[3-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazin-1-yl]ethanoate Openeye Name: methyl 2-[3-[2-(2-furylmethylamino)-2-oxo-ethyl]-4-oxo-phthalazin-1-yl]acetate CAS Name: 2-[3-[2-(2-furanylmethylamino)-2-oxoethyl]-4-oxo-1-phthalazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[3-[2-(furan-2-ylmethylamino)-2-oxoethyl]-4-oxophthalazin-1-yl]acetate Traditional Name: 2-[3-[2-(2-furfurylamino)-2-keto-ethyl]-4-keto-phthalazin-1-yl]acetic acid methyl ester Formula: C18H17N3O5 MolecularWeight: 355.34468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=NN(C(=O)C2=CC=CC=C21)CC(=O)NCC3=CC=CO3

Isomeric SMILES

COC(=O)CC1=NN(C(=O)C2=CC=CC=C21)CC(=O)NCC3=CC=CO3

InChI

InChI=1S/C18H17N3O5/c1-25-17(23)9-15-13-6-2-3-7-14(13)18(24)21(20-15)11-16(22)19-10-12-5-4-8-26-12/h2-8H,9-11H2,1H3,(H,19,22)