2-(3-indol-1-ylpropylamino)-5-nitro-benzenecarbonitrile

Systemtic Name: 2-(3-indol-1-ylpropylamino)-5-nitro-benzenecarbonitrile Openeye Name: 2-(3-indol-1-ylpropylamino)-5-nitro-benzonitrile CAS Name: 2-[3-(1-indolyl)propylamino]-5-nitrobenzonitrile IUPAC Name: 2-(3-indol-1-ylpropylamino)-5-nitrobenzonitrile Traditional Name: 2-(3-indol-1-ylpropylamino)-5-nitro-benzonitrile Formula: C18H16N4O2 MolecularWeight: 320.34524

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CN2CCCNC3=C(C=C(C=C3)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC=C2C(=C1)C=CN2CCCNC3=C(C=C(C=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C18H16N4O2/c19-13-15-12-16(22(23)24)6-7-17(15)20-9-3-10-21-11-8-14-4-1-2-5-18(14)21/h1-2,4-8,11-12,20H,3,9-10H2