[2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)ethanoate

Systemtic Name: [2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)ethanoate Openeye Name: [2-(1-ethylpropylamino)-2-oxo-ethyl] 2-(3-methyl-4-oxo-phthalazin-1-yl)acetate CAS Name: 2-(3-methyl-4-oxo-1-phthalazinyl)acetic acid [2-oxo-2-(pentan-3-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-3-ylamino)ethyl] 2-(3-methyl-4-oxophthalazin-1-yl)acetate Traditional Name: 2-(4-keto-3-methyl-phthalazin-1-yl)acetic acid [2-(1-ethylpropylamino)-2-keto-ethyl] ester Formula: C18H23N3O4 MolecularWeight: 345.39292

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)COC(=O)CC1=NN(C(=O)C2=CC=CC=C21)C

Isomeric SMILES

CCC(CC)NC(=O)COC(=O)CC1=NN(C(=O)C2=CC=CC=C21)C

InChI

InChI=1S/C18H23N3O4/c1-4-12(5-2)19-16(22)11-25-17(23)10-15-13-8-6-7-9-14(13)18(24)21(3)20-15/h6-9,12H,4-5,10-11H2,1-3H3,(H,19,22)