4-[[3-[(1,4-dimethylpyrrolidin-2-yl)methyl]-1H-indol-5-yl]amino]-3-nitro-benzenecarbonitrile

Systemtic Name: 4-[[3-[(1,4-dimethylpyrrolidin-2-yl)methyl]-1H-indol-5-yl]amino]-3-nitro-benzenecarbonitrile Openeye Name: 4-[[3-[(1,4-dimethylpyrrolidin-2-yl)methyl]-1H-indol-5-yl]amino]-3-nitro-benzonitrile CAS Name: 4-[[3-[(1,4-dimethyl-2-pyrrolidinyl)methyl]-1H-indol-5-yl]amino]-3-nitrobenzonitrile IUPAC Name: 4-[[3-[(1,4-dimethylpyrrolidin-2-yl)methyl]-1H-indol-5-yl]amino]-3-nitrobenzonitrile Traditional Name: 4-[[3-[(1,4-dimethylpyrrolidin-2-yl)methyl]-1H-indol-5-yl]amino]-3-nitro-benzonitrile Formula: C22H23N5O2 MolecularWeight: 389.45032

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(N(C1)C)CC2=CNC3=C2C=C(C=C3)NC4=C(C=C(C=C4)C#N)[N+](=O)[O-]

Isomeric SMILES

CC1CC(N(C1)C)CC2=CNC3=C2C=C(C=C3)NC4=C(C=C(C=C4)C#N)[N+](=O)[O-]

InChI

InChI=1S/C22H23N5O2/c1-14-7-18(26(2)13-14)9-16-12-24-20-6-4-17(10-19(16)20)25-21-5-3-15(11-23)8-22(21)27(28)29/h3-6,8,10,12,14,18,24-25H,7,9,13H2,1-2H3