N,N-diethyl-4-(4-oxidanylidene-3-pentyl-phthalazin-1-yl)carbonyl-piperazine-1-carboxamide

Systemtic Name: N,N-diethyl-4-(4-oxidanylidene-3-pentyl-phthalazin-1-yl)carbonyl-piperazine-1-carboxamide Openeye Name: N,N-diethyl-4-(4-oxo-3-pentyl-phthalazine-1-carbonyl)piperazine-1-carboxamide CAS Name: N,N-diethyl-4-[oxo-(4-oxo-3-pentyl-1-phthalazinyl)methyl]-1-piperazinecarboxamide IUPAC Name: N,N-diethyl-4-(4-oxo-3-pentylphthalazine-1-carbonyl)piperazine-1-carboxamide Traditional Name: 4-(3-amyl-4-keto-phthalazine-1-carbonyl)-N,N-diethyl-piperazine-1-carboxamide Formula: C23H33N5O3 MolecularWeight: 427.53982

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)C(=O)N(CC)CC

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)C(=O)N(CC)CC

InChI

InChI=1S/C23H33N5O3/c1-4-7-10-13-28-21(29)19-12-9-8-11-18(19)20(24-28)22(30)26-14-16-27(17-15-26)23(31)25(5-2)6-3/h8-9,11-12H,4-7,10,13-17H2,1-3H3