methyl 1-[2-(4-aminocarbonyl-1-oxidanylidene-phthalazin-2-yl)ethanoylamino]cyclohexane-1-carboxylate

Systemtic Name: methyl 1-[2-(4-aminocarbonyl-1-oxidanylidene-phthalazin-2-yl)ethanoylamino]cyclohexane-1-carboxylate Openeye Name: methyl 1-[[2-(4-carbamoyl-1-oxo-phthalazin-2-yl)acetyl]amino]cyclohexanecarboxylate CAS Name: 1-[[2-(4-carbamoyl-1-oxo-2-phthalazinyl)-1-oxoethyl]amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-[[2-(4-carbamoyl-1-oxophthalazin-2-yl)acetyl]amino]cyclohexane-1-carboxylate Traditional Name: 1-[[2-(4-carbamoyl-1-keto-phthalazin-2-yl)acetyl]amino]cyclohexanecarboxylic acid methyl ester Formula: C19H22N4O5 MolecularWeight: 386.40178

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCCCC1)NC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)N

Isomeric SMILES

COC(=O)C1(CCCCC1)NC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)N

InChI

InChI=1S/C19H22N4O5/c1-28-18(27)19(9-5-2-6-10-19)21-14(24)11-23-17(26)13-8-4-3-7-12(13)15(22-23)16(20)25/h3-4,7-8H,2,5-6,9-11H2,1H3,(H2,20,25)(H,21,24)