3-[2-(1H-imidazol-5-yl)ethylamino]-2-[(triphenylmethyl)amino]butanoate

Systemtic Name: 3-[2-(1H-imidazol-5-yl)ethylamino]-2-[(triphenylmethyl)amino]butanoate Openeye Name: 3-[2-(1H-imidazol-5-yl)ethylamino]-2-(tritylamino)butanoate CAS Name: 3-[2-(1H-imidazol-5-yl)ethylamino]-2-[(triphenylmethyl)amino]butanoate IUPAC Name: 3-[2-(1H-imidazol-5-yl)ethylamino]-2-(tritylamino)butanoate Traditional Name: 3-[2-(1H-imidazol-5-yl)ethylamino]-2-(tritylamino)butyrate Formula: C28H29N4O2- MolecularWeight: 453.55546

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)[O-])NC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)NCCC4=CN=CN4

Isomeric SMILES

CC(C(C(=O)[O-])NC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)NCCC4=CN=CN4

InChI

InChI=1S/C28H30N4O2/c1-21(30-18-17-25-19-29-20-31-25)26(27(33)34)32-28(22-11-5-2-6-12-22,23-13-7-3-8-14-23)24-15-9-4-10-16-24/h2-16,19-21,26,30,32H,17-18H2,1H3,(H,29,31)(H,33,34)/p-1