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

Systemtic Name: 4-bromanyl-N-(3-cyano-1-ethyl-6-nitro-indol-2-yl)benzamide Openeye Name: 4-bromo-N-(3-cyano-1-ethyl-6-nitro-indol-2-yl)benzamide CAS Name: 4-bromo-N-(3-cyano-1-ethyl-6-nitro-2-indolyl)benzamide IUPAC Name: 4-bromo-N-(3-cyano-1-ethyl-6-nitroindol-2-yl)benzamide Traditional Name: 4-bromo-N-(3-cyano-1-ethyl-6-nitro-indol-2-yl)benzamide Formula: C18H13BrN4O3 MolecularWeight: 413.22482

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H13BrN4O3/c1-2-22-16-9-13(23(25)26)7-8-14(16)15(10-20)17(22)21-18(24)11-3-5-12(19)6-4-11/h3-9H,2H2,1H3,(H,21,24)