6-[3-(2-azanylethyl)indol-1-yl]-5-nitro-pyrimidin-4-amine

Systemtic Name: 6-[3-(2-azanylethyl)indol-1-yl]-5-nitro-pyrimidin-4-amine Openeye Name: 6-[3-(2-aminoethyl)indol-1-yl]-5-nitro-pyrimidin-4-amine CAS Name: 6-[3-(2-aminoethyl)-1-indolyl]-5-nitro-4-pyrimidinamine IUPAC Name: 6-[3-(2-aminoethyl)indol-1-yl]-5-nitropyrimidin-4-amine Traditional Name: [6-[3-(2-aminoethyl)indol-1-yl]-5-nitro-pyrimidin-4-yl]amine Formula: C14H14N6O2 MolecularWeight: 298.29996

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2C3=C(C(=NC=N3)N)[N+](=O)[O-])CCN

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2C3=C(C(=NC=N3)N)[N+](=O)[O-])CCN

InChI

InChI=1S/C14H14N6O2/c15-6-5-9-7-19(11-4-2-1-3-10(9)11)14-12(20(21)22)13(16)17-8-18-14/h1-4,7-8H,5-6,15H2,(H2,16,17,18)