(E)-2-(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)-3-(3-nitrophenyl)prop-2-enenitrile

Systemtic Name: (E)-2-(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)-3-(3-nitrophenyl)prop-2-enenitrile Openeye Name: (E)-2-(4-amino-6-anilino-1,3,5-triazin-2-yl)-3-(3-nitrophenyl)prop-2-enenitrile CAS Name: (E)-2-(4-amino-6-anilino-1,3,5-triazin-2-yl)-3-(3-nitrophenyl)-2-propenenitrile IUPAC Name: (E)-2-(4-amino-6-anilino-1,3,5-triazin-2-yl)-3-(3-nitrophenyl)prop-2-enenitrile Traditional Name: (E)-2-(4-amino-6-anilino-s-triazin-2-yl)-3-(3-nitrophenyl)acrylonitrile Formula: C18H13N7O2 MolecularWeight: 359.34152

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)C(=CC3=CC(=CC=C3)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)/C(=C/C3=CC(=CC=C3)[N+](=O)[O-])/C#N

InChI

InChI=1S/C18H13N7O2/c19-11-13(9-12-5-4-8-15(10-12)25(26)27)16-22-17(20)24-18(23-16)21-14-6-2-1-3-7-14/h1-10H,(H3,20,21,22,23,24)/b13-9+