2-azanyl-4-(3-nitro-4-propan-2-yl-phenyl)buta-1,3-diene-1,1,3-tricarbonitrile

Systemtic Name: 2-azanyl-4-(3-nitro-4-propan-2-yl-phenyl)buta-1,3-diene-1,1,3-tricarbonitrile Openeye Name: 2-amino-4-(4-isopropyl-3-nitro-phenyl)buta-1,3-diene-1,1,3-tricarbonitrile CAS Name: 2-amino-4-(3-nitro-4-propan-2-ylphenyl)buta-1,3-diene-1,1,3-tricarbonitrile IUPAC Name: 2-amino-4-(3-nitro-4-propan-2-ylphenyl)buta-1,3-diene-1,1,3-tricarbonitrile Traditional Name: 2-amino-4-(4-isopropyl-3-nitro-phenyl)buta-1,3-diene-1,1,3-tricarbonitrile Formula: C16H13N5O2 MolecularWeight: 307.30672

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=C(C=C1)C=C(C#N)C(=C(C#N)C#N)N)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=C(C=C(C=C1)C=C(C#N)C(=C(C#N)C#N)N)[N+](=O)[O-]

InChI

InChI=1S/C16H13N5O2/c1-10(2)14-4-3-11(6-15(14)21(22)23)5-12(7-17)16(20)13(8-18)9-19/h3-6,10H,20H2,1-2H3