5-(4-nitrophenyl)-6-(phenylmethoxymethyl)pyrimidine-2,4-diamine

Systemtic Name: 5-(4-nitrophenyl)-6-(phenylmethoxymethyl)pyrimidine-2,4-diamine Openeye Name: 6-(benzyloxymethyl)-5-(4-nitrophenyl)pyrimidine-2,4-diamine CAS Name: 5-(4-nitrophenyl)-6-(phenylmethoxymethyl)pyrimidine-2,4-diamine IUPAC Name: 5-(4-nitrophenyl)-6-(phenylmethoxymethyl)pyrimidine-2,4-diamine Traditional Name: [2-amino-6-(benzoxymethyl)-5-(4-nitrophenyl)pyrimidin-4-yl]amine Formula: C18H17N5O3 MolecularWeight: 351.35928

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCC2=C(C(=NC(=N2)N)N)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)COCC2=C(C(=NC(=N2)N)N)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H17N5O3/c19-17-16(13-6-8-14(9-7-13)23(24)25)15(21-18(20)22-17)11-26-10-12-4-2-1-3-5-12/h1-9H,10-11H2,(H4,19,20,21,22)