ethyl 1-[2-[[3-(2,4-dimethoxyphenyl)-4-oxidanylidene-phthalazin-1-yl]carbonylamino]ethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[[3-(2,4-dimethoxyphenyl)-4-oxidanylidene-phthalazin-1-yl]carbonylamino]ethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[[3-(2,4-dimethoxyphenyl)-4-oxo-phthalazine-1-carbonyl]amino]acetyl]piperidine-4-carboxylate CAS Name: 1-[2-[[[3-(2,4-dimethoxyphenyl)-4-oxo-1-phthalazinyl]-oxomethyl]amino]-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[[3-(2,4-dimethoxyphenyl)-4-oxophthalazine-1-carbonyl]amino]acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[[3-(2,4-dimethoxyphenyl)-4-keto-phthalazine-1-carbonyl]amino]acetyl]isonipecotic acid ethyl ester Formula: C27H30N4O7 MolecularWeight: 522.5497

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=C(C=C(C=C4)OC)OC

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=C(C=C(C=C4)OC)OC

InChI

InChI=1S/C27H30N4O7/c1-4-38-27(35)17-11-13-30(14-12-17)23(32)16-28-25(33)24-19-7-5-6-8-20(19)26(34)31(29-24)21-10-9-18(36-2)15-22(21)37-3/h5-10,15,17H,4,11-14,16H2,1-3H3,(H,28,33)