4-[[[4-(cyclopropylamino)-5-nitro-pyrimidin-2-yl]amino]methyl]phenol

Systemtic Name: 4-[[[4-(cyclopropylamino)-5-nitro-pyrimidin-2-yl]amino]methyl]phenol Openeye Name: 4-[[[4-(cyclopropylamino)-5-nitro-pyrimidin-2-yl]amino]methyl]phenol CAS Name: 4-[[[4-(cyclopropylamino)-5-nitro-2-pyrimidinyl]amino]methyl]phenol IUPAC Name: 4-[[[4-(cyclopropylamino)-5-nitropyrimidin-2-yl]amino]methyl]phenol Traditional Name: 4-[[[4-(cyclopropylamino)-5-nitro-pyrimidin-2-yl]amino]methyl]phenol Formula: C14H15N5O3 MolecularWeight: 301.3006

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=NC(=NC=C2[N+](=O)[O-])NCC3=CC=C(C=C3)O

Isomeric SMILES

C1CC1NC2=NC(=NC=C2[N+](=O)[O-])NCC3=CC=C(C=C3)O

InChI

InChI=1S/C14H15N5O3/c20-11-5-1-9(2-6-11)7-15-14-16-8-12(19(21)22)13(18-14)17-10-3-4-10/h1-2,5-6,8,10,20H,3-4,7H2,(H2,15,16,17,18)