4-oxidanylidene-N-[[2-(piperidin-1-ylmethyl)phenyl]methyl]-3-propyl-phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-N-[[2-(piperidin-1-ylmethyl)phenyl]methyl]-3-propyl-phthalazine-1-carboxamide Openeye Name: 4-oxo-N-[[2-(1-piperidylmethyl)phenyl]methyl]-3-propyl-phthalazine-1-carboxamide CAS Name: 4-oxo-N-[[2-(1-piperidinylmethyl)phenyl]methyl]-3-propyl-1-phthalazinecarboxamide IUPAC Name: 4-oxo-N-[[2-(piperidin-1-ylmethyl)phenyl]methyl]-3-propylphthalazine-1-carboxamide Traditional Name: 4-keto-N-[2-(piperidinomethyl)benzyl]-3-propyl-phthalazine-1-carboxamide Formula: C25H30N4O2 MolecularWeight: 418.5313

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3=CC=CC=C3CN4CCCCC4

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3=CC=CC=C3CN4CCCCC4

InChI

InChI=1S/C25H30N4O2/c1-2-14-29-25(31)22-13-7-6-12-21(22)23(27-29)24(30)26-17-19-10-4-5-11-20(19)18-28-15-8-3-9-16-28/h4-7,10-13H,2-3,8-9,14-18H2,1H3,(H,26,30)