4-oxidanylidene-N-pentyl-3-(phenylmethyl)phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-N-pentyl-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-4-oxo-N-pentyl-phthalazine-1-carboxamide CAS Name: 4-oxo-N-pentyl-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-4-oxo-N-pentylphthalazine-1-carboxamide Traditional Name: N-amyl-3-benzyl-4-keto-phthalazine-1-carboxamide Formula: C21H23N3O2 MolecularWeight: 349.42622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C1=NN(C(=O)C2=CC=CC=C21)CC3=CC=CC=C3

Isomeric SMILES

CCCCCNC(=O)C1=NN(C(=O)C2=CC=CC=C21)CC3=CC=CC=C3

InChI

InChI=1S/C21H23N3O2/c1-2-3-9-14-22-20(25)19-17-12-7-8-13-18(17)21(26)24(23-19)15-16-10-5-4-6-11-16/h4-8,10-13H,2-3,9,14-15H2,1H3,(H,22,25)