3-[(5-nitro-2,3-dihydroindol-1-yl)carbonyl]benzenecarbonitrile

Systemtic Name: 3-[(5-nitro-2,3-dihydroindol-1-yl)carbonyl]benzenecarbonitrile Openeye Name: 3-(5-nitroindoline-1-carbonyl)benzonitrile CAS Name: 3-[(5-nitro-2,3-dihydroindol-1-yl)-oxomethyl]benzonitrile IUPAC Name: 3-(5-nitro-2,3-dihydroindole-1-carbonyl)benzonitrile Traditional Name: 3-(5-nitroindoline-1-carbonyl)benzonitrile Formula: C16H11N3O3 MolecularWeight: 293.27684

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=C1C=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

C1CN(C2=C1C=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C16H11N3O3/c17-10-11-2-1-3-13(8-11)16(20)18-7-6-12-9-14(19(21)22)4-5-15(12)18/h1-5,8-9H,6-7H2