methyl 2-[(3S)-2-oxidanylidene-3-[[1-(triphenylmethyl)imidazol-4-yl]methyl]piperazin-1-yl]ethanoate

Systemtic Name: methyl 2-[(3S)-2-oxidanylidene-3-[[1-(triphenylmethyl)imidazol-4-yl]methyl]piperazin-1-yl]ethanoate Openeye Name: methyl 2-[(3S)-2-oxo-3-[(1-tritylimidazol-4-yl)methyl]piperazin-1-yl]acetate CAS Name: 2-[(3S)-2-oxo-3-[[1-(triphenylmethyl)-4-imidazolyl]methyl]-1-piperazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[(3S)-2-oxo-3-[(1-tritylimidazol-4-yl)methyl]piperazin-1-yl]acetate Traditional Name: 2-[(3S)-2-keto-3-[(1-tritylimidazol-4-yl)methyl]piperazino]acetic acid methyl ester Formula: C30H30N4O3 MolecularWeight: 494.5842

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1CCNC(C1=O)CC2=CN(C=N2)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

COC(=O)CN1CCN[C@H](C1=O)CC2=CN(C=N2)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C30H30N4O3/c1-37-28(35)21-33-18-17-31-27(29(33)36)19-26-20-34(22-32-26)30(23-11-5-2-6-12-23,24-13-7-3-8-14-24)25-15-9-4-10-16-25/h2-16,20,22,27,31H,17-19,21H2,1H3/t27-/m0/s1