N-[2-(1H-indol-3-yl)ethyl]-3,5-dinitro-benzamide

Systemtic Name: N-[2-(1H-indol-3-yl)ethyl]-3,5-dinitro-benzamide Openeye Name: N-[2-(1H-indol-3-yl)ethyl]-3,5-dinitro-benzamide CAS Name: N-[2-(1H-indol-3-yl)ethyl]-3,5-dinitrobenzamide IUPAC Name: N-[2-(1H-indol-3-yl)ethyl]-3,5-dinitrobenzamide Traditional Name: N-[2-(1H-indol-3-yl)ethyl]-3,5-dinitro-benzamide Formula: C17H14N4O5 MolecularWeight: 354.31686

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CCNC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CCNC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H14N4O5/c22-17(12-7-13(20(23)24)9-14(8-12)21(25)26)18-6-5-11-10-19-16-4-2-1-3-15(11)16/h1-4,7-10,19H,5-6H2,(H,18,22)