N-[[(2R,6R)-2,6-dimethylcyclohexylidene]amino]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide

Systemtic Name: N-[[(2R,6R)-2,6-dimethylcyclohexylidene]amino]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-N-[[(2R,6R)-2,6-dimethylcyclohexylidene]amino]-4-oxo-phthalazine-1-carboxamide CAS Name: N-[[(2R,6R)-2,6-dimethylcyclohexylidene]amino]-4-oxo-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-N-[[(2R,6R)-2,6-dimethylcyclohexylidene]amino]-4-oxophthalazine-1-carboxamide Traditional Name: 3-benzyl-N-[[(2R,6R)-2,6-dimethylcyclohexylidene]amino]-4-keto-phthalazine-1-carboxamide Formula: C24H26N4O2 MolecularWeight: 402.48884

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1=NNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4)C

Isomeric SMILES

C[C@@H]1CCC[C@H](C1=NNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4)C

InChI

InChI=1S/C24H26N4O2/c1-16-9-8-10-17(2)21(16)25-26-23(29)22-19-13-6-7-14-20(19)24(30)28(27-22)15-18-11-4-3-5-12-18/h3-7,11-14,16-17H,8-10,15H2,1-2H3,(H,26,29)/t16-,17-/m1/s1