6-chloranyl-5-nitro-N-[4-(triphenylmethyl)oxybutyl]pyrimidin-4-amine

Systemtic Name: 6-chloranyl-5-nitro-N-[4-(triphenylmethyl)oxybutyl]pyrimidin-4-amine Openeye Name: 6-chloro-5-nitro-N-(4-trityloxybutyl)pyrimidin-4-amine CAS Name: 6-chloro-5-nitro-N-[4-(triphenylmethyl)oxybutyl]-4-pyrimidinamine IUPAC Name: 6-chloro-5-nitro-N-(4-trityloxybutyl)pyrimidin-4-amine Traditional Name: (6-chloro-5-nitro-pyrimidin-4-yl)-(4-trityloxybutyl)amine Formula: C27H25ClN4O3 MolecularWeight: 488.9654

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)OCCCCNC4=C(C(=NC=N4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)OCCCCNC4=C(C(=NC=N4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C27H25ClN4O3/c28-25-24(32(33)34)26(31-20-30-25)29-18-10-11-19-35-27(21-12-4-1-5-13-21,22-14-6-2-7-15-22)23-16-8-3-9-17-23/h1-9,12-17,20H,10-11,18-19H2,(H,29,30,31)