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

Systemtic Name: ethyl 1-[2-[[3-(4-methoxyphenyl)-4-oxidanylidene-phthalazin-1-yl]carbonylamino]ethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[[3-(4-methoxyphenyl)-4-oxo-phthalazine-1-carbonyl]amino]acetyl]piperidine-4-carboxylate CAS Name: 1-[2-[[[3-(4-methoxyphenyl)-4-oxo-1-phthalazinyl]-oxomethyl]amino]-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[[3-(4-methoxyphenyl)-4-oxophthalazine-1-carbonyl]amino]acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[[4-keto-3-(4-methoxyphenyl)phthalazine-1-carbonyl]amino]acetyl]isonipecotic acid ethyl ester Formula: C26H28N4O6 MolecularWeight: 492.52372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H28N4O6/c1-3-36-26(34)17-12-14-29(15-13-17)22(31)16-27-24(32)23-20-6-4-5-7-21(20)25(33)30(28-23)18-8-10-19(35-2)11-9-18/h4-11,17H,3,12-16H2,1-2H3,(H,27,32)