N-(3-ethylphenyl)-3-hexyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-(3-ethylphenyl)-3-hexyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-(3-ethylphenyl)-3-hexyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-(3-ethylphenyl)-3-hexyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-(3-ethylphenyl)-3-hexyl-4-oxophthalazine-1-carboxamide Traditional Name: N-(3-ethylphenyl)-3-hexyl-4-keto-phthalazine-1-carboxamide Formula: C23H27N3O2 MolecularWeight: 377.47938

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=CC(=C3)CC

Isomeric SMILES

CCCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=CC(=C3)CC

InChI

InChI=1S/C23H27N3O2/c1-3-5-6-9-15-26-23(28)20-14-8-7-13-19(20)21(25-26)22(27)24-18-12-10-11-17(4-2)16-18/h7-8,10-14,16H,3-6,9,15H2,1-2H3,(H,24,27)