3-[5-[[4-(aminomethyl)piperidin-1-yl]methyl]-1H-indol-2-yl]-2-oxidanylidene-1H-quinoline-7-carbonitrile

Systemtic Name: 3-[5-[[4-(aminomethyl)piperidin-1-yl]methyl]-1H-indol-2-yl]-2-oxidanylidene-1H-quinoline-7-carbonitrile Openeye Name: 3-[5-[[4-(aminomethyl)-1-piperidyl]methyl]-1H-indol-2-yl]-2-oxo-1H-quinoline-7-carbonitrile CAS Name: 3-[5-[[4-(aminomethyl)-1-piperidinyl]methyl]-1H-indol-2-yl]-2-oxo-1H-quinoline-7-carbonitrile IUPAC Name: 3-[5-[[4-(aminomethyl)piperidin-1-yl]methyl]-1H-indol-2-yl]-2-oxo-1H-quinoline-7-carbonitrile Traditional Name: 3-[5-[[4-(aminomethyl)piperidino]methyl]-1H-indol-2-yl]-2-keto-1H-quinoline-7-carbonitrile Formula: C25H25N5O MolecularWeight: 411.4989

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN)CC2=CC3=C(C=C2)NC(=C3)C4=CC5=C(C=C(C=C5)C#N)NC4=O

Isomeric SMILES

C1CN(CCC1CN)CC2=CC3=C(C=C2)NC(=C3)C4=CC5=C(C=C(C=C5)C#N)NC4=O

InChI

InChI=1S/C25H25N5O/c26-13-16-5-7-30(8-6-16)15-18-2-4-22-20(9-18)12-24(28-22)21-11-19-3-1-17(14-27)10-23(19)29-25(21)31/h1-4,9-12,16,28H,5-8,13,15,26H2,(H,29,31)