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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)CN1C(=O)C2=CC=CC=C2C(=O)N1

Isomeric SMILES

CC(C)CC(C(=O)OC)NC(=O)CN1C(=O)C2=CC=CC=C2C(=O)N1

InChI

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