methyl 3-[5-[(E)-[4-oxidanylidene-1-(triphenylmethyl)piperidin-3-ylidene]methyl]-1,2,3-triazol-1-yl]propanoate

Systemtic Name: methyl 3-[5-[(E)-[4-oxidanylidene-1-(triphenylmethyl)piperidin-3-ylidene]methyl]-1,2,3-triazol-1-yl]propanoate Openeye Name: methyl 3-[5-[(E)-(4-oxo-1-trityl-3-piperidylidene)methyl]triazol-1-yl]propanoate CAS Name: 3-[5-[(E)-[4-oxo-1-(triphenylmethyl)-3-piperidinylidene]methyl]-1-triazolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[5-[(E)-(4-oxo-1-tritylpiperidin-3-ylidene)methyl]triazol-1-yl]propanoate Traditional Name: 3-[5-[(E)-(4-keto-1-trityl-3-piperidylidene)methyl]triazol-1-yl]propionic acid methyl ester Formula: C31H30N4O3 MolecularWeight: 506.5949

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCN1C(=CN=N1)C=C2CN(CCC2=O)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

COC(=O)CCN1C(=CN=N1)/C=C/2\CN(CCC2=O)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H30N4O3/c1-38-30(37)18-20-35-28(22-32-33-35)21-24-23-34(19-17-29(24)36)31(25-11-5-2-6-12-25,26-13-7-3-8-14-26)27-15-9-4-10-16-27/h2-16,21-22H,17-20,23H2,1H3/b24-21+