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

Systemtic Name: [2-oxidanylidene-2-(2,4,4-trimethylpentan-2-ylamino)ethyl] 2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)ethanoate Openeye Name: [2-oxo-2-(1,1,3,3-tetramethylbutylamino)ethyl] 2-(3-methyl-4-oxo-phthalazin-1-yl)acetate CAS Name: 2-(3-methyl-4-oxo-1-phthalazinyl)acetic acid [2-oxo-2-(2,4,4-trimethylpentan-2-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(2,4,4-trimethylpentan-2-ylamino)ethyl] 2-(3-methyl-4-oxophthalazin-1-yl)acetate Traditional Name: 2-(4-keto-3-methyl-phthalazin-1-yl)acetic acid [2-keto-2-(1,1,3,3-tetramethylbutylamino)ethyl] ester Formula: C21H29N3O4 MolecularWeight: 387.47266

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29N3O4/c1-20(2,3)13-21(4,5)22-17(25)12-28-18(26)11-16-14-9-7-8-10-15(14)19(27)24(6)23-16/h7-10H,11-13H2,1-6H3,(H,22,25)