methyl 6-[2-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]ethanoylamino]hexanoate

Systemtic Name: methyl 6-[2-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]ethanoylamino]hexanoate Openeye Name: methyl 6-[[2-(1,4-dioxo-3H-phthalazin-2-yl)acetyl]amino]hexanoate CAS Name: 6-[[2-(1,4-dioxo-3H-phthalazin-2-yl)-1-oxoethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[[2-(1,4-dioxo-3H-phthalazin-2-yl)acetyl]amino]hexanoate Traditional Name: 6-[[2-(1,4-diketo-3H-phthalazin-2-yl)acetyl]amino]hexanoic acid methyl ester Formula: C17H21N3O5 MolecularWeight: 347.36574

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCNC(=O)CN1C(=O)C2=CC=CC=C2C(=O)N1

Isomeric SMILES

COC(=O)CCCCCNC(=O)CN1C(=O)C2=CC=CC=C2C(=O)N1

InChI

InChI=1S/C17H21N3O5/c1-25-15(22)9-3-2-6-10-18-14(21)11-20-17(24)13-8-5-4-7-12(13)16(23)19-20/h4-5,7-8H,2-3,6,9-11H2,1H3,(H,18,21)(H,19,23)