3-[2-(cyclohexylcarbamoylamino)-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxylic acid

Systemtic Name: 3-[2-(cyclohexylcarbamoylamino)-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxylic acid Openeye Name: 3-[2-(cyclohexylcarbamoylamino)-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxylic acid CAS Name: 3-[2-[[(cyclohexylamino)-oxomethyl]amino]-2-oxoethyl]-4-oxo-1-phthalazinecarboxylic acid IUPAC Name: 3-[2-(cyclohexylcarbamoylamino)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid Traditional Name: 3-[2-(cyclohexylcarbamoylamino)-2-keto-ethyl]-4-keto-phthalazine-1-carboxylic acid Formula: C18H20N4O5 MolecularWeight: 372.3752

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)NC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)O

Isomeric SMILES

C1CCC(CC1)NC(=O)NC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)O

InChI

InChI=1S/C18H20N4O5/c23-14(20-18(27)19-11-6-2-1-3-7-11)10-22-16(24)13-9-5-4-8-12(13)15(21-22)17(25)26/h4-5,8-9,11H,1-3,6-7,10H2,(H,25,26)(H2,19,20,23,27)