N-(3-cyano-1-ethyl-6-nitro-indol-2-yl)-3-nitro-benzamide

Systemtic Name: N-(3-cyano-1-ethyl-6-nitro-indol-2-yl)-3-nitro-benzamide Openeye Name: N-(3-cyano-1-ethyl-6-nitro-indol-2-yl)-3-nitro-benzamide CAS Name: N-(3-cyano-1-ethyl-6-nitro-2-indolyl)-3-nitrobenzamide IUPAC Name: N-(3-cyano-1-ethyl-6-nitroindol-2-yl)-3-nitrobenzamide Traditional Name: N-(3-cyano-1-ethyl-6-nitro-indol-2-yl)-3-nitro-benzamide Formula: C18H13N5O5 MolecularWeight: 379.32632

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=CC(=C2)[N+](=O)[O-])C(=C1NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C#N

Isomeric SMILES

CCN1C2=C(C=CC(=C2)[N+](=O)[O-])C(=C1NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C18H13N5O5/c1-2-21-16-9-13(23(27)28)6-7-14(16)15(10-19)17(21)20-18(24)11-4-3-5-12(8-11)22(25)26/h3-9H,2H2,1H3,(H,20,24)