3-butyl-N-(2,3-dimethylcyclohexyl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-butyl-N-(2,3-dimethylcyclohexyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-butyl-N-(2,3-dimethylcyclohexyl)-4-oxo-phthalazine-1-carboxamide CAS Name: 3-butyl-N-(2,3-dimethylcyclohexyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-butyl-N-(2,3-dimethylcyclohexyl)-4-oxophthalazine-1-carboxamide Traditional Name: 3-butyl-N-(2,3-dimethylcyclohexyl)-4-keto-phthalazine-1-carboxamide Formula: C21H29N3O2 MolecularWeight: 355.47386

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3CCCC(C3C)C

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3CCCC(C3C)C

InChI

InChI=1S/C21H29N3O2/c1-4-5-13-24-21(26)17-11-7-6-10-16(17)19(23-24)20(25)22-18-12-8-9-14(2)15(18)3/h6-7,10-11,14-15,18H,4-5,8-9,12-13H2,1-3H3,(H,22,25)