6-(benzotriazol-1-yl)-N-naphthalen-1-yl-5-nitro-pyrimidin-4-amine

Systemtic Name: 6-(benzotriazol-1-yl)-N-naphthalen-1-yl-5-nitro-pyrimidin-4-amine Openeye Name: 6-(benzotriazol-1-yl)-N-(1-naphthyl)-5-nitro-pyrimidin-4-amine CAS Name: 6-(1-benzotriazolyl)-N-(1-naphthalenyl)-5-nitro-4-pyrimidinamine IUPAC Name: 6-(benzotriazol-1-yl)-N-naphthalen-1-yl-5-nitropyrimidin-4-amine Traditional Name: [6-(benzotriazol-1-yl)-5-nitro-pyrimidin-4-yl]-(1-naphthyl)amine Formula: C20H13N7O2 MolecularWeight: 383.36292

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2NC3=NC=NC(=C3[N+](=O)[O-])N4C5=CC=CC=C5N=N4

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2NC3=NC=NC(=C3[N+](=O)[O-])N4C5=CC=CC=C5N=N4

InChI

InChI=1S/C20H13N7O2/c28-27(29)18-19(23-15-10-5-7-13-6-1-2-8-14(13)15)21-12-22-20(18)26-17-11-4-3-9-16(17)24-25-26/h1-12H,(H,21,22,23)