3-(3,4-dimethoxyphenyl)-N-[2-[(2,3-dimethylcyclohexyl)amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-(3,4-dimethoxyphenyl)-N-[2-[(2,3-dimethylcyclohexyl)amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-(3,4-dimethoxyphenyl)-N-[2-[(2,3-dimethylcyclohexyl)amino]-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-(3,4-dimethoxyphenyl)-N-[2-[(2,3-dimethylcyclohexyl)amino]-2-oxoethyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-(3,4-dimethoxyphenyl)-N-[2-[(2,3-dimethylcyclohexyl)amino]-2-oxoethyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-(3,4-dimethoxyphenyl)-N-[2-[(2,3-dimethylcyclohexyl)amino]-2-keto-ethyl]-4-keto-phthalazine-1-carboxamide Formula: C27H32N4O5 MolecularWeight: 492.56678

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NC(=O)CNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC1CCCC(C1C)NC(=O)CNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C27H32N4O5/c1-16-8-7-11-21(17(16)2)29-24(32)15-28-26(33)25-19-9-5-6-10-20(19)27(34)31(30-25)18-12-13-22(35-3)23(14-18)36-4/h5-6,9-10,12-14,16-17,21H,7-8,11,15H2,1-4H3,(H,28,33)(H,29,32)