N-(4-methylpentyl)-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide

Systemtic Name: N-(4-methylpentyl)-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide Openeye Name: N-isohexyl-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: N-(4-methylpentyl)-4-oxo-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-(4-methylpentyl)-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: N-isohexyl-4-keto-3-propyl-phthalazine-1-carboxamide Formula: C18H25N3O2 MolecularWeight: 315.41

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCCCC(C)C

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCCCC(C)C

InChI

InChI=1S/C18H25N3O2/c1-4-12-21-18(23)15-10-6-5-9-14(15)16(20-21)17(22)19-11-7-8-13(2)3/h5-6,9-10,13H,4,7-8,11-12H2,1-3H3,(H,19,22)