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

Systemtic Name: ethyl 4-[2-[[3-(3,4-dimethoxyphenyl)-4-oxidanylidene-phthalazin-1-yl]carbonylamino]ethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[[3-(3,4-dimethoxyphenyl)-4-oxo-phthalazine-1-carbonyl]amino]acetyl]piperazine-1-carboxylate CAS Name: 4-[2-[[[3-(3,4-dimethoxyphenyl)-4-oxo-1-phthalazinyl]-oxomethyl]amino]-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[[3-(3,4-dimethoxyphenyl)-4-oxophthalazine-1-carbonyl]amino]acetyl]piperazine-1-carboxylate Traditional Name: 4-[2-[[3-(3,4-dimethoxyphenyl)-4-keto-phthalazine-1-carbonyl]amino]acetyl]piperazine-1-carboxylic acid ethyl ester Formula: C26H29N5O7 MolecularWeight: 523.53776

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C26H29N5O7/c1-4-38-26(35)30-13-11-29(12-14-30)22(32)16-27-24(33)23-18-7-5-6-8-19(18)25(34)31(28-23)17-9-10-20(36-2)21(15-17)37-3/h5-10,15H,4,11-14,16H2,1-3H3,(H,27,33)