3-nitro-4-(phenethylamino)benzenecarbonitrile

Systemtic Name: 3-nitro-4-(phenethylamino)benzenecarbonitrile Openeye Name: 3-nitro-4-(phenethylamino)benzonitrile CAS Name: 3-nitro-4-(phenethylamino)benzonitrile IUPAC Name: 3-nitro-4-(phenethylamino)benzonitrile Traditional Name: 3-nitro-4-(phenethylamino)benzonitrile Formula: C15H13N3O2 MolecularWeight: 267.28262

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC2=C(C=C(C=C2)C#N)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCNC2=C(C=C(C=C2)C#N)[N+](=O)[O-]

InChI

InChI=1S/C15H13N3O2/c16-11-13-6-7-14(15(10-13)18(19)20)17-9-8-12-4-2-1-3-5-12/h1-7,10,17H,8-9H2