2-azanyl-4-cyclopropyl-6-(3-nitrophenyl)cyclohexa-2,4-diene-1,1,3-tricarbonitrile

Systemtic Name: 2-azanyl-4-cyclopropyl-6-(3-nitrophenyl)cyclohexa-2,4-diene-1,1,3-tricarbonitrile Openeye Name: 2-amino-4-cyclopropyl-6-(3-nitrophenyl)cyclohexa-2,4-diene-1,1,3-tricarbonitrile CAS Name: 2-amino-4-cyclopropyl-6-(3-nitrophenyl)cyclohexa-2,4-diene-1,1,3-tricarbonitrile IUPAC Name: 2-amino-4-cyclopropyl-6-(3-nitrophenyl)cyclohexa-2,4-diene-1,1,3-tricarbonitrile Traditional Name: 2-amino-4-cyclopropyl-6-(3-nitrophenyl)cyclohexa-2,4-diene-1,1,3-tricarbonitrile Formula: C18H13N5O2 MolecularWeight: 331.32812

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=CC(C(C(=C2C#N)N)(C#N)C#N)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CC1C2=CC(C(C(=C2C#N)N)(C#N)C#N)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H13N5O2/c19-8-15-14(11-4-5-11)7-16(18(9-20,10-21)17(15)22)12-2-1-3-13(6-12)23(24)25/h1-3,6-7,11,16H,4-5,22H2