methyl 3-(2-nitroimidazol-1-yl)-2-[(triphenylmethyl)amino]propanoate

Systemtic Name: methyl 3-(2-nitroimidazol-1-yl)-2-[(triphenylmethyl)amino]propanoate Openeye Name: methyl 3-(2-nitroimidazol-1-yl)-2-(tritylamino)propanoate CAS Name: 3-(2-nitro-1-imidazolyl)-2-[(triphenylmethyl)amino]propanoic acid methyl ester IUPAC Name: methyl 3-(2-nitroimidazol-1-yl)-2-(tritylamino)propanoate Traditional Name: 3-(2-nitroimidazol-1-yl)-2-(tritylamino)propionic acid methyl ester Formula: C26H24N4O4 MolecularWeight: 456.49316

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CN1C=CN=C1[N+](=O)[O-])NC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C(CN1C=CN=C1[N+](=O)[O-])NC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H24N4O4/c1-34-24(31)23(19-29-18-17-27-25(29)30(32)33)28-26(20-11-5-2-6-12-20,21-13-7-3-8-14-21)22-15-9-4-10-16-22/h2-18,23,28H,19H2,1H3